canonical_smiles	compound_chembl_id	standard_relation	standard_value	publication_year	document_chembl_id
Cc1nc2ccccn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	CHEMBL3649423	=	126.0	2014	CHEMBL3639163
O=S(=O)(Nc1cncc(-c2cnc3ccccn23)c1)c1ccc(F)cc1	CHEMBL3649424	=	1291.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccccn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649441	=	28.0	2014	CHEMBL3639163
Cc1ccn2c(-c3cnc(Cl)c(NS(=O)(=O)c4ccc(F)cc4)c3)cnc2c1	CHEMBL3649442	=	19.0	2014	CHEMBL3639163
Cc1nc2ccc(Br)cn2c1-c1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	CHEMBL3649425	=	20.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccc(Br)cn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649426	=	6.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccc(-c4ccncc4)cn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649427	=	2.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccc(-c4cccnc4)cn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649428	=	1.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccc(N4CCOCC4)cn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649429	=	4.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccccn23)cnc1OC	CHEMBL3649443	>	1500.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccc(Br)cn23)cnc1OC	CHEMBL3649430	=	779.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccc(-c4ccncc4)cn23)cnc1OC	CHEMBL3649431	=	626.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccc(N4CCOC4=O)cn23)cnc1OC	CHEMBL3649432	>	1500.0	2014	CHEMBL3639163
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL2171918	=	30.17	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cccc(F)c2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL2171919	=	155.9	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL2171923	=	18.24	2014	CHEMBL3638615
Cc1c(-c2cccnc2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL2171920	=	26.81	2014	CHEMBL3638615
Cc1c(-c2cccc(C#N)c2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698285	=	154.13	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2c(F)cccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698286	=	93.68	2014	CHEMBL3638615
Cc1c(-c2ccncc2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698287	=	233.97	2014	CHEMBL3638615
Cc1c(-c2cccnc2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698288	=	47.5	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL2171929	=	6.759	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(-c3ccnc(N)n3)cc21	CHEMBL2171927	=	9.774	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(-c3ccnc(N)n3)cc21	CHEMBL2171930	=	3.323	2014	CHEMBL3638615
CC(C)c1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698289	=	5.868	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL2171931	=	9.877	2014	CHEMBL3638615
Cc1ncccc1-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698290	=	14.52	2014	CHEMBL3638615
Cc1ncccc1-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(N4CCOCC4)cc32)c1C	CHEMBL3698291	=	4.071	2014	CHEMBL3638615
COCCN(C)c1cnc2c(c1)N(c1c(C)c(-c3ccccn3)nc3cc(F)ccc13)CC2(C)C	CHEMBL3698292	=	55.84	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(-c3cn[nH]c3)cc21	CHEMBL3698293	=	95.17	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(-c3ncnc4nc[nH]c34)cc21	CHEMBL3698294	=	29.01	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(C(N)=O)cc21	CHEMBL3698295	=	494.8	2014	CHEMBL3638615
Cc1cc(C)cc(-c2nc3cc(F)ccc3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3698296	=	15.64	2014	CHEMBL3638615
Cc1cc(-c2ccc3c(c2)N(c2c(C)c(-c4ccccn4)nc4cc(F)ccc24)CC3(C)C)nc(N)n1	CHEMBL2171928	=	449.15	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(-c3nc(N)ncc3Cl)cc21	CHEMBL3698297	=	1427.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2S(C)(=O)=O)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698298	=	10.22	2014	CHEMBL3638615
Cc1c(-c2ccccc2S(C)(=O)=O)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698299	=	4.434	2014	CHEMBL3638615
Cc1c(-c2ccccc2S(C)(=O)=O)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(-c3ccnc(N)n3)cc21	CHEMBL3698300	=	2.437	2014	CHEMBL3638615
Cc1c(-c2cccc(=O)[nH]2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698301	=	155.3	2014	CHEMBL3638615
Cc1c(-c2ccccc2S(C)(=O)=O)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698302	=	7.801	2014	CHEMBL3638615
Cc1c(-c2cccc(=O)[nH]2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698303	=	14.74	2014	CHEMBL3638615
COc1cccc(-c2nc3cc(F)ccc3c(N3CC4(CCOCC4)c4ccc(N5CCOCC5)cc43)c2C)n1	CHEMBL3698304	=	68.84	2014	CHEMBL3638615
Cc1c(-c2cccc(S(C)(=O)=O)c2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698305	=	127.15	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698306	=	21.09	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cccc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698307	=	3.327	2014	CHEMBL3638615
Cc1c(-c2cc(F)ccc2F)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698308	=	20.3	2014	CHEMBL3638615
Cc1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698309	=	3078.5	2014	CHEMBL3638615
Cc1c(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc2cccc(F)c2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698310	=	3779.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2cccc(Cl)c2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698311	=	890.4	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2c(C)ccc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698312	=	4.072	2014	CHEMBL3638615
CC1(C)CN(c2c(C#N)c(-c3ccccn3)nc3cc(F)ccc23)c2cc(N3CCOCC3)cnc21	CHEMBL3698313	=	437.1	2014	CHEMBL3638615
Cc1c(N2CCCCC2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698314	=	73.7	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)cc43)c2cc1Cl	CHEMBL3698315	=	196.0	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)cc43)c2cc1C	CHEMBL3698316	=	622.0	2014	CHEMBL3638615
Cc1cc(Cl)c2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)cc43)c2c1	CHEMBL3698317	=	3179.0	2014	CHEMBL3638615
COc1cc(OC)c2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)cc43)c2c1	CHEMBL3639971	=	3969.0	2014	CHEMBL3638615
COc1ccccc1-c1cc(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c2cc(Cl)ccc2n1	CHEMBL3698318	=	5563.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(-c4ccncc4)cc32)c1C	CHEMBL3698319	=	1703.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(-c4cn[nH]c4)cc32)c1C	CHEMBL3698320	=	9533.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL2171933	=	626.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(N2CCOc3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698321	=	1258.0	2014	CHEMBL3638615
COc1cc(-c2ccncc2)cc2c1ccn2-c1c(C)c(C)nc2ccc(Cl)cc12	CHEMBL3698322	=	1439.0	2014	CHEMBL3638615
COc1cc(-c2cn[nH]c2)cc2c1ccn2-c1c(C)c(C)nc2ccc(Cl)cc12	CHEMBL3698323	=	2054.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(-n2ccc3c(O)cc(-c4cn[nH]c4)cc32)c1C	CHEMBL3698324	=	4110.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(-n2ccc3c(C#N)cc(-c4ccncc4)cc32)c1C	CHEMBL3698325	=	1481.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(-n2ccc3c(C#N)cc(-c4cn[nH]c4)cc32)c1C	CHEMBL3698326	=	1083.0	2014	CHEMBL3638615
Cc1c(C(F)(F)F)nc2ccc(Cl)cc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698327	=	985.0	2014	CHEMBL3638615
COc1cc(N2CCOCC2)cc2c1ccn2-c1c(C)c(C)nc2ccc(Cl)cc12	CHEMBL3698328	=	3710.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(-n2ccc3c(C#N)cc(N4CCOCC4)cc32)c1C	CHEMBL3698329	=	153.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(N2CC3(CCOCC3)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698330	=	73.0	2014	CHEMBL3638615
Cc1nc2ccccc2c(N2CC3(CCOCC3)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL2171921	=	450.0	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CC4(CCOCC4)c4ccc(Br)cc43)c2cc1Cl	CHEMBL3698331	=	571.0	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CC4(CCOCC4)c4ccc(C#N)cc43)c2cc1Cl	CHEMBL3698332	=	7500.0	2014	CHEMBL3638615
Cc1nc2c(C)cccc2c(N2CC3(CCOCC3)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698333	=	121.0	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CC(C)(C)c4ccc(N5CCOCC5)c(C)c43)c2cc1Cl	CHEMBL3698334	=	3961.0	2014	CHEMBL3638615
CC1(C)CN(c2c3c(nc4ccc(Cl)cc24)CCC3)c2cc(N3CCOCC3)ccc21	CHEMBL3698335	=	772.0	2014	CHEMBL3638615
CC1(C)CN(c2c3c(nc4ccc(Cl)cc24)CCCC3)c2cc(N3CCOCC3)ccc21	CHEMBL3698336	=	2624.0	2014	CHEMBL3638615
CC1(C)CN(c2c3c(nc4ccc(Cl)cc24)C(C)(C)CC3)c2cc(N3CCOCC3)ccc21	CHEMBL3698337	=	111.0	2014	CHEMBL3638615
Cc1cnc2ccccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698338	=	654.37	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(-c3ccncc3)cc21	CHEMBL2171926	=	5029.5	2014	CHEMBL3638615
Cc1nc2c(C)cc(Cl)cc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698339	=	618.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2ccccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL2171935	=	47.0	2014	CHEMBL3638615
Cc1nc2c(C)cccc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698340	=	44.0	2014	CHEMBL3638615
Cc1nc2c(Cl)cccc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698341	=	50.0	2014	CHEMBL3638615
Cc1nc2c(C(F)(F)F)cccc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL3698342	=	516.0	2014	CHEMBL3638615
Cc1nc2ccc(Cl)cc2c(-n2cc(C#N)c3ccc(-c4cn[nH]c4)cc32)c1C	CHEMBL3698343	=	2110.0	2014	CHEMBL3638615
CCc1c(C)nc2ccc(Cl)cc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698344	=	1134.0	2014	CHEMBL3638615
Cc1nc2ccccc2c(N2CC(C)(C)c3ccc(N4CCOCC4)cc32)c1C	CHEMBL2171932	=	362.0	2014	CHEMBL3638615
COc1cc2nc(C)c(C)c(N3CCS(=O)(=O)c4ccc(N5CCOCC5)cc43)c2cc1Cl	CHEMBL3698345	=	28.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2cccc(F)c2c1N1CCS(=O)(=O)c2ccc(N3CCOCC3)cc21	CHEMBL3698346	=	23.47	2014	CHEMBL3638615
Cc1c(-c2ccccc2)nc2ccccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL2171934	=	85.36	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698347	=	25.38	2014	CHEMBL3638615
Cc1c(-c2ccccc2)nc2ccccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL2171922	=	91.28	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2cc(Cl)ccc2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3698348	=	570.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2F)nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(N3CCOCC3)cc21	CHEMBL3698349	=	196.99	2014	CHEMBL3638615
Cc1c(Cc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698350	=	3.2	2014	CHEMBL3638615
C=C(c1ccccc1)c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(N4CCOCC4)cc32)c1C	CHEMBL3698351	=	2.9	2014	CHEMBL3638615
Cc1c(-c2cccc3ccccc23)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698352	=	230.0	2014	CHEMBL3638615
Cc1c(-c2ccc3c(ccn3C)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698353	=	194.8	2014	CHEMBL3638615
Cc1c(-c2cccc3[nH]ccc23)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698354	=	2.766	2014	CHEMBL3638615
Cc1c(Cc2cccc(F)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698355	=	2.874	2014	CHEMBL3638615
Cc1c(CCc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698356	=	8.121	2014	CHEMBL3638615
Cc1c(Cc2cccc(C#N)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698357	=	2.676	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CCOc2ccc(N3CCOCC3)cc21	CHEMBL3698358	=	351.0	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(C3=CCOCC3)cc21	CHEMBL3698359	=	6.47	2014	CHEMBL3638615
Cc1c(/C=C/c2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698360	=	88.3	2014	CHEMBL3638615
Cc1c(Nc2ccccn2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698361	=	17.1	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cccc(F)c2c1N1CCS(=O)(=O)c2ncc(N3CCOCC3)cc21	CHEMBL3698362	=	12.9	2014	CHEMBL3638615
Cc1c(C2(c3ccccc3)CC2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698363	=	21.8	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cc(F)ccc3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3698364	=	4.17	2014	CHEMBL3638615
Cc1c(N2CCCCC2=O)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698365	=	3.14	2014	CHEMBL3638615
COc1cccc(Cc2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3698366	=	2.34	2014	CHEMBL3638615
Cc1c(Cc2cccc(C(F)(F)F)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698367	=	17.3	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3698368	=	18.4	2014	CHEMBL3638615
Cc1c(-c2cncc(F)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3698369	=	5.21	2014	CHEMBL3638615
Cc1cncc(-c2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3698370	=	3.0	2014	CHEMBL3638615
Cc1c(-c2cncc(S(C)(=O)=O)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701637	=	16.7	2014	CHEMBL3638615
Cc1c(N2CCCC2=O)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701638	=	1.54	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cc(F)cc(F)c3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701639	=	8.82	2014	CHEMBL3638615
Cc1c(N2CCCCC2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701640	=	5.51	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701641	=	9.44	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cccc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701642	=	6.48	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(-c3cn[nH]c3)cc21	CHEMBL3701643	=	320.0	2014	CHEMBL3638615
Cc1c(-c2ccccc2S(C)(=O)=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701644	=	4.51	2014	CHEMBL3638615
Cc1c(-n2ccccc2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ccc(N3CCOCC3)cc21	CHEMBL3701645	=	4.64	2014	CHEMBL3638615
Cc1nc2c(Cl)cccc2c(N2CC3(CCOCC3)c3ncc(N4CCOCC4)cc32)c1C	CHEMBL3701646	=	2.68	2014	CHEMBL3638615
Cc1c(N2CCCC2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701647	=	2.36	2014	CHEMBL3638615
Cc1c(N2CCCCC2=O)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701648	=	1.62	2014	CHEMBL3638615
Cc1cc(C)cc(-c2nc3cc(F)ccc3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701649	=	12.1	2014	CHEMBL3638615
Cc1ccc(S(C)(=O)=O)c(-c2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL2216891	=	1.05	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cc(F)ccc3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701650	=	5.19	2014	CHEMBL3638615
COc1cc(-c2nc3cc(F)cc(F)c3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)ccn1	CHEMBL3701651	=	6.89	2014	CHEMBL3638615
Cc1c(N2CCOC(C)(C)C2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701652	=	5.4	2014	CHEMBL3638615
Cc1c(N2CCOC(C)(C)C2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701653	=	1.52	2014	CHEMBL3638615
Cc1ccc(S(C)(=O)=O)c(-c2nc3cc(F)cc(F)c3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701654	=	1.51	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CCS(=O)(=O)c2ncc(N3CCOCC3)cc21	CHEMBL3701655	=	2.22	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cc(F)ccc3c(N3CCS(=O)(=O)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701656	=	1.96	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2ncccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701657	=	65.9	2014	CHEMBL3638615
Cc1c(N2CCCC2=O)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701658	=	7.64	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2ncccc2c1N1CCOc2ccc(N3CCOCC3)cc21	CHEMBL3701659	=	883.0	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701660	=	12.5	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cnccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701661	=	30.7	2014	CHEMBL3638615
Cc1c(-c2cc(F)cc(F)c2)nc2cnccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701662	=	28.2	2014	CHEMBL3638615
Cc1c(-c2cc(F)cc(F)c2)nc2cnccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701663	=	13.4	2014	CHEMBL3638615
Cc1ccnc(-c2nc3ncccc3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701664	=	2.36	2014	CHEMBL3638615
Cc1c(-c2cc(F)cc(F)c2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701665	=	10.0	2014	CHEMBL3638615
COC(=O)N1CCN(c2nc3cc(F)cc(F)c3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)CC1	CHEMBL3701666	=	3.11	2014	CHEMBL3638615
Cc1c(N2CC(C)(C)CCC2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701667	=	1.49	2014	CHEMBL3638615
Cc1c(N2CCN(C(=O)OC(C)(C)C)CC2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701668	=	2.7	2014	CHEMBL3638615
Cc1c(N2CCNCC2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701669	=	12.4	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCS(=O)(=O)CC2)c2ccc(N3CCOCC3)cc21	CHEMBL3701670	=	1.37	2014	CHEMBL3638615
Cc1c(N2CCN(S(C)(=O)=O)CC2)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701671	=	64.4	2014	CHEMBL3638615
Cc1c(-c2cccc(F)c2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701672	=	2.3	2014	CHEMBL3638615
Cc1c(-c2cccc(F)c2)nc2ncccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701673	=	5.38	2014	CHEMBL3638615
Cc1c(-c2ccccc2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701674	=	27.8	2014	CHEMBL3638615
Cc1c(-c2ccccc2)nc2ncccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701675	=	4.36	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(Br)c(N3CCOCC3)cc21	CHEMBL3701676	=	22.6	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(C#N)c(N3CCOCC3)cc21	CHEMBL3701677	=	41.6	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(N)c(N3CCOCC3)cc21	CHEMBL3701678	=	219.0	2014	CHEMBL3638615
C=Cc1nc2c(cc1N1CCOCC1)N(c1c(C)c(-c3ccccn3)nc3cc(F)ccc13)CC21CCOCC1	CHEMBL3701679	=	29.0	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CCOCC2)c2nc(Cl)c(N3CCOCC3)cc21	CHEMBL3701680	=	94.1	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2nc(Br)c(N3CCOCC3)cc21	CHEMBL3701681	=	13.3	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2nc(C#N)c(N3CCOCC3)cc21	CHEMBL3701682	=	33.3	2014	CHEMBL3638615
Cc1ccnc(-c2nc3ncccc3c(N3CC(C)(C)c4nc(Cl)c(N5CCOCC5)cc43)c2C)c1	CHEMBL3701683	=	49.5	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(C)(C)c2nc(Cl)c(N3CCOCC3)cc21	CHEMBL3640005	=	68.7	2014	CHEMBL3638615
CNC(=O)N1CCN(c2nc3cc(F)cc(F)c3c(N3CC4(CCOCC4)c4ncc(N5CCOCC5)cc43)c2C)CC1	CHEMBL3701684	=	3.16	2014	CHEMBL3638615
Cc1c(N2CCC2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701685	=	1.27	2014	CHEMBL3638615
Cc1c(N2CC(C)(C)CC2=O)nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701686	=	2.3	2014	CHEMBL3638615
Cc1c(-c2cncc(F)c2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701687	=	2.24	2014	CHEMBL3638615
Cc1ccnc(-c2nc3cnccc3c(N3CC(C)(C)c4ncc(N5CCOCC5)cc43)c2C)c1	CHEMBL3701688	=	53.0	2014	CHEMBL3638615
Cc1c(-c2cncc(F)c2)nc2cnccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701689	=	5.37	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC2(CS(=O)(=O)C2)c2ccc(N3CCOCC3)cc21	CHEMBL2171924	=	7.75	2014	CHEMBL3638615
Cc1c(-c2ccccn2)nc2cc(F)ccc2c1N1CC(CO)(CO)c2ccc(N3CCOCC3)cc21	CHEMBL2171925	=	80.5	2014	CHEMBL3638615
Cc1c(C2CC2)nc2ncccc2c1N1CC(C)(C)c2ncc(N3CCOCC3)cc21	CHEMBL3701690	=	154.0	2014	CHEMBL3638615
Cc1c(-c2cc(F)cc(F)c2)nc2ncccc2c1N1CC2(CCOCC2)c2ncc(N3CCOCC3)cc21	CHEMBL3701691	=	32.0	2014	CHEMBL3638615
CC(=O)Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1	CHEMBL3643917	>	1500.0	2014	CHEMBL3638541
Nc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cn1	CHEMBL3643918	>	1500.0	2014	CHEMBL3638541
c1cnc(Nc2cccc3n[nH]cc23)c(-c2ncnc3nc[nH]c23)c1	CHEMBL2165040	=	22621.0	2014	CHEMBL3638541
c1cnc(Nc2cccc3[nH]ccc23)c(-c2ncnc3[nH]cnc23)c1	CHEMBL3643919	=	5618.0	2014	CHEMBL3638541
COc1ccc(Nc2ncccc2-c2ncnc3nc[nH]c23)cn1	CHEMBL2165041	=	7277.0	2014	CHEMBL3638541
Nc1cc(-c2cccnc2Nc2cccc3[nH]ncc23)nc(C(F)(F)F)n1	CHEMBL2165036	=	3139.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cccc3[nH]ccc23)n1	CHEMBL2165268	=	187.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cccc(O)c2)n1	CHEMBL2165052	=	13.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cccc3[nH]ncc23)n1	CHEMBL2165053	=	33.0	2014	CHEMBL3638541
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165269	=	107.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cccnc2Nc2cccc(O)c2)n1	CHEMBL2165270	=	24.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cccnc2Nc2cccc3[nH]ncc23)n1	CHEMBL2165271	=	130.0	2014	CHEMBL3638541
Cc1nc(N)c(F)c(-c2cccnc2Nc2cccc3[nH]ncc23)n1	CHEMBL2165035	=	802.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cccc(O)c2)n1	CHEMBL3643920	=	8.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165024	=	242.0	2014	CHEMBL3638541
Cc1cnc(Nc2cccnc2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3643921	=	191.0	2014	CHEMBL3638541
COc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2165025	=	55.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2ncnc(C)n2)cn1	CHEMBL3643922	=	1577.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165017	=	9.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cccc3[nH]ncc23)n1	CHEMBL3643923	=	4.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc(C(F)(F)F)nc2)n1	CHEMBL2170094	=	129.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cncnc2)n1	CHEMBL3643924	=	17.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3ncoc3c2)n1	CHEMBL3643925	=	55.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170096	=	9.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165013	=	61.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165010	=	104.0	2014	CHEMBL3638541
Cc1cnc(Nc2cccc3[nH]ccc23)c(-c2nc(C)nc(N)n2)c1	CHEMBL3643926	=	130.0	2014	CHEMBL3638541
Cc1cnc(Nc2cccc3[nH]ncc23)c(-c2nc(C)nc(N)n2)c1	CHEMBL3643927	=	36.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Br)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165023	=	247.0	2014	CHEMBL3638541
CCOc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cn1	CHEMBL3643928	=	500.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(N)nc2)n1	CHEMBL3643929	=	1334.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(Cl)nc2)n1	CHEMBL3643931	=	160.0	2014	CHEMBL3638541
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2c[nH]nc2n1	CHEMBL2165042	=	1411.0	2014	CHEMBL3638541
Cc1nc(-c2cccnc2Nc2cccc3[nH]ccc23)c2[nH]cnc2n1	CHEMBL2165038	=	181.0	2014	CHEMBL3638541
Cc1nc(-c2cccnc2Nc2cccc3n[nH]cc23)c2[nH]cnc2n1	CHEMBL2165037	=	36.0	2014	CHEMBL3638541
COc1ccc(Nc2ncccc2-c2nc(C)nc3nc[nH]c23)cn1	CHEMBL2165039	=	62.0	2014	CHEMBL3638541
Cc1nc(-c2cc(Cl)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3643932	=	720.0	2014	CHEMBL3638541
Cc1nc(-c2cc(Br)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3643933	=	50.0	2014	CHEMBL3638541
Cc1nc(-c2cc(C(F)(F)F)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3643934	=	119.0	2014	CHEMBL3638541
COc1ncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3643935	=	62.0	2014	CHEMBL3638541
COc1ccc(COCc2cnc(Nc3cccc4[nH]ccc34)c(-c3nc(C)nc4[nH]cnc34)c2)cc1	CHEMBL3643936	=	402.0	2014	CHEMBL3638541
Cc1nc(-c2cc(CO)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3643937	=	33.0	2014	CHEMBL3638541
C=Cc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc3[nH]cnc23)c1	CHEMBL3643938	=	83.0	2014	CHEMBL3638541
CCc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc3[nH]cnc23)c1	CHEMBL3643939	=	11.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CCO)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3643940	=	23.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3643941	=	44.0	2014	CHEMBL3638541
COc1ccc(NCc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)cc1	CHEMBL3643942	=	35.0	2014	CHEMBL3638541
COc1cccc(NCc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)c1	CHEMBL3643943	=	22.0	2014	CHEMBL3638541
COc1ccc(CN(Cc2ccc(OC)cc2)c2nc(C)nc(Cl)n2)cc1.COc1ccc(CNc2nc(C)nc(Cl)n2)cc1.Cc1nc(Cl)nc(Cl)n1.Clc1nc(Cl)nc(Cl)n1	CHEMBL3643930	=	9.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNc3cccnn3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646427	=	33.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646428	=	42.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646429	=	25.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646430	=	45.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCNCC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646431	=	97.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646432	=	19.0	2014	CHEMBL3638541
COC(=O)N1CCN(Cc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)CC1	CHEMBL3646433	=	18.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(C(=O)N(C)C)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646434	=	43.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(=O)(=O)N(C)C)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646435	=	7.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(C(C)=O)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646436	=	42.0	2014	CHEMBL3638541
COc1ccc(Nc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)cc1	CHEMBL3646437	=	9.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(NCc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646438	=	57.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Nc3ccccc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646439	=	33.0	2014	CHEMBL3638541
COCCNc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc3[nH]cnc23)c1	CHEMBL3646440	=	104.0	2014	CHEMBL3638541
CCNc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc3[nH]cnc23)c1	CHEMBL3646441	=	181.0	2014	CHEMBL3638541
COc1ccc(CNc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)cc1	CHEMBL3639453	=	77.0	2014	CHEMBL3638541
COc1cccc(Nc2cnc(Nc3ccc(OC)nc3)c(-c3nc(C)nc4[nH]cnc34)c2)c1	CHEMBL3646442	=	35.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CCOCC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646443	=	107.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CCC(O)C3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646444	=	79.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646445	=	23.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CCC[C@H]3CO)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646446	=	29.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CCC[C@@H]3CO)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646447	=	40.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1	CHEMBL3646448	=	462.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Cc3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646449	=	2.0	2014	CHEMBL3638541
Cc1nc(-c2cc(Cc3ccc(S(C)(=O)=O)cc3)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3646450	=	3.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(Cc3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646451	=	9.0	2014	CHEMBL3638541
Cc1nc(-c2cc(Cc3ccc(S(C)(=O)=O)cc3)cnc2Nc2ccc(N)nc2)c2nc[nH]c2n1	CHEMBL3649475	=	12.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cnccc2Nc2cccc3[nH]ncc23)n1	CHEMBL3646452	=	359.0	2014	CHEMBL3638541
CC(=O)Nc1cc(-c2cnccc2Nc2cccc3[nH]ccc23)nc(C)n1	CHEMBL3646453	=	2725.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cnccc2Nc2cccc3[nH]ccc23)n1	CHEMBL3649476	=	1914.0	2014	CHEMBL3638541
Cc1nc(-c2cnccc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1	CHEMBL3646454	=	264.0	2014	CHEMBL3638541
COc1ccc(Nc2ccncc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646455	=	252.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2nccnc2Nc2cccc3[nH]ncc23)n1	CHEMBL3646456	=	98.0	2014	CHEMBL3638541
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646457	=	38.0	2014	CHEMBL3638541
COc1ccc(Nc2nccnc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165050	=	327.0	2014	CHEMBL3638541
COc1ccc(Nc2cnccc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165047	=	868.0	2014	CHEMBL3638541
COc1ccc(Nc2nccnc2-c2cc(N)nc(C)n2)cn1	CHEMBL2165021	=	59.0	2014	CHEMBL3638541
COc1ccc(Nc2ncncc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165049	=	18.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(N)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646458	=	113.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(OC)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646459	=	18.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(N3CCOCC3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646460	=	97.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(N(C)C)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646461	=	45.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(N3CCCC3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646462	=	51.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(N3CCCCC3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646463	=	102.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(-c3ccncc3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646464	=	282.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(-c3ccc(F)cc3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646465	=	504.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(NC3CCCC3)ncc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646466	=	145.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646467	=	11.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3ocnc3c2)n1	CHEMBL3646468	=	7.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCOCC3)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646469	=	100.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646470	=	20.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(O)C(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646471	=	12.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@@H](O)C(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646472	=	12.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@H](O)C(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3649477	=	31.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNC(C)(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646473	=	217.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNC(C)C)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646474	=	120.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNCc3ccccn3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646475	=	54.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNCc3ccncc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646476	=	40.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNCc3cccnc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646477	=	48.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(O)c3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646478	=	5.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646479	=	6.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Cc3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165007	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(Cc3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646480	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646481	=	2.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646482	=	7.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646483	=	8.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3649478	=	6.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170099	=	4.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170081	=	4.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)c3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646484	=	5.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)c3ccc(S(C)(=O)=O)cc3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646485	=	1.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(=O)N3CCOCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646486	=	64.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(=O)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646487	=	10.0	2014	CHEMBL3638541
COCCNC(=O)c1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3646488	=	21.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCOCC3=O)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646489	=	33.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CC3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165020	=	9.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Cc3ccccc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165006	=	65.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(C)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165014	=	258.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@H]3C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646490	=	7.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(C(=O)N(C)C)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646491	=	11.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(C(=O)N(C)C)CC3)cnc2Nc2cnc(O)c(F)c2)n1	CHEMBL3649479	=	505.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cnc(O)c(F)c2)n1	CHEMBL3646492	=	36.0	2014	CHEMBL3638541
COc1cncc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)c1	CHEMBL2170098	=	9.0	2014	CHEMBL3638541
CNc1nc(C)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc(OC)nc2)n1	CHEMBL3646493	=	7.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cccc(OC(F)F)c2)n1	CHEMBL3646494	=	963.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc3oc(C)nc3c2)n1	CHEMBL3646495	=	178.0	2014	CHEMBL3638541
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646496	=	177.0	2014	CHEMBL3638541
COc1cc(Nc2ncccc2-c2nc(C)nc(N)n2)ccc1F	CHEMBL3646497	=	457.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc3c(c2)OC(F)(F)O3)n1	CHEMBL3646498	=	610.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3ccc(OC)nc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646499	=	17.0	2014	CHEMBL3638541
COc1ccc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1OC	CHEMBL3646500	=	560.0	2014	CHEMBL3638541
Cc1ccc2cc(Nc3ncccc3-c3nc(C)nc(N)n3)ccc2n1	CHEMBL3646501	=	611.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3ccccn3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646502	=	6.0	2014	CHEMBL3638541
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1Cl	CHEMBL3646503	=	60.0	2014	CHEMBL3638541
Cc1cncc(Nc2ncccc2-c2nc(C)nc(N)n2)c1	CHEMBL3646504	=	455.0	2014	CHEMBL3638541
COc1ncc(Nc2nc(-c3ccncc3)ccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646505	=	63.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(=O)N3CCC(O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646506	=	44.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2cc(N)nc(C)n2)cn1	CHEMBL3646507	=	6.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CO)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165026	=	63.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2nc3ccccc3nc2Nc2cccc3[nH]ncc23)n1	CHEMBL3646508	=	124.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)cc1Cl	CHEMBL3646509	=	754.0	2014	CHEMBL3638541
Cc1nc(-c2cccnc2Nc2ccc(NC(=O)C3CC3)cc2)c2nc[nH]c2n1	CHEMBL3646510	=	344.0	2014	CHEMBL3638541
COc1cncc(Nc2ncccc2-c2nc(C)nc3[nH]cnc23)c1	CHEMBL3646511	=	26.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165022	=	70.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(F)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646512	=	22.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(F)cnc2Nc2cncc(F)c2)n1	CHEMBL3646513	=	851.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C=O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646514	=	13.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(Cl)cnc2NC2CCOCC2)n1	CHEMBL3646515	=	2082.0	2014	CHEMBL3638541
COCCNc1nc(C)nc(-c2cc(Cl)cnc2Nc2cnc(OC)c(F)c2)n1	CHEMBL3646516	=	409.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(NC(=O)Nc3ccccc3)nc2)n1	CHEMBL3646517	=	2.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(NC(=O)Nc3cccc(F)c3)nc2)n1	CHEMBL3646518	=	4.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(NC(=O)NC(C)C)nc2)n1	CHEMBL3646519	=	691.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646520	=	80.0	2014	CHEMBL3638541
COC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646521	=	153.0	2014	CHEMBL3638541
COCCOc1ccc(NC(=O)Nc2ccc(Nc3ncc(Cl)cc3-c3nc(C)nc(N)n3)cn2)cc1	CHEMBL3646522	=	16.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646523	=	52.0	2014	CHEMBL3638541
COc1ncc(Nc2nc(C)ccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646524	=	33.0	2014	CHEMBL3638541
COc1ncc(Nc2nc(CN3CCOCC3)ccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646525	=	276.0	2014	CHEMBL3638541
COc1ncc(Nc2nc(COCC(F)(F)F)ccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646526	=	68.0	2014	CHEMBL3638541
Cc1ccc(-c2nc(C)nc(N)n2)c(Nc2cncc(F)c2)n1	CHEMBL3646527	=	180.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCSCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646528	=	94.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC[S+]([O-])CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646529	=	147.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cnc3c(c2)ncn3C)n1	CHEMBL3646530	=	16.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CC[C@H](CO)C3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646531	=	40.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CC[C@H](O)C3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646532	=	47.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(N3CC[C@@H](O)C3)cc2-c2nc(C)nc3[nH]cnc23)cn1	CHEMBL3646533	=	68.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2170095	=	8.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCN(S(=O)(=O)N(C)C)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165018	=	17.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCC(O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165011	=	199.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC[C@@H](CO)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165012	=	278.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646534	=	93.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165034	=	160.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165008	=	266.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCCCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165009	=	153.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC(S(C)(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646535	=	6.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCC(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165019	=	22.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CNCCO)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646536	=	135.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN[C@H](C)CO)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646537	=	354.0	2014	CHEMBL3638541
COCCNCc1cnc(Nc2ccc(OC)nc2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2165028	=	283.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCC(S(C)(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165004	=	16.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC(O)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646538	=	59.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC4(C3)NC(=O)NC4=O)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646539	=	68.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC(N)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646540	=	446.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CC(NS(C)(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3639454	=	39.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(CN3CCn4ncnc4C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646541	=	41.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(O)c3cc(Br)ccc3S(=O)(=O)N(C)C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646542	=	23.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(O)c3ccc(S(=O)(=O)N(C)C)cc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646543	=	4.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(N)c3ccc(S(=O)(=O)N(C)C)cc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646544	=	18.0	2014	CHEMBL3638541
COc1ccc(Nc2nc3ccccc3cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646545	=	45.0	2014	CHEMBL3638541
COc1ccc(Nc2ccccc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165046	=	396.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646546	=	8.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3ncsc3c2)n1	CHEMBL3646547	=	43.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cncc(F)c2)n1	CHEMBL2170097	=	15.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cn[nH]c2)n1	CHEMBL3646548	=	163.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cc[nH]n2)n1	CHEMBL3646549	=	1459.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2cc(F)cc3[nH]ncc23)n1	CHEMBL3646550	=	8.0	2014	CHEMBL3638541
COc1ncc(Nc2ncccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3357863	=	19.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3cnn(C)c3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165033	=	8.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2ccc(F)c(F)c2)n1	CHEMBL3646551	=	442.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C3=CCNCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646552	=	21.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3cn[nH]c3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646553	=	11.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3ccc(C)nc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165032	=	8.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3ccnnc3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646554	=	60.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(-c3cncc(F)c3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646555	=	12.0	2014	CHEMBL3638541
COc1ccc(Nc2nc(-c3cccnc3)ccc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646556	=	67.0	2014	CHEMBL3638541
COc1ncc(Nc2nc(-c3cccnc3)ccc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646557	=	4.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C3=CCOCC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL2165030	=	5.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(Cl)cnc2Nc2cncc(F)c2)n1	CHEMBL3646558	=	426.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(-c3cnn(C)c3)cnc2Nc2cncc(F)c2)n1	CHEMBL3646559	=	14.0	2014	CHEMBL3638541
COCCOc1ccc(-c2nc(C)nc(N)n2)c(Nc2cnc(OC)c(F)c2)n1	CHEMBL3646560	=	81.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3[nH]cnc3c2)n1	CHEMBL3646561	=	16.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCNCC3)cnc2Nc2ccc3[nH]cnc3c2)n1	CHEMBL3646562	=	69.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(OC(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646563	=	47.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cc[nH]c(=O)c2)n1	CHEMBL3646564	=	643.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(Cl)c(NS(=O)(=O)c3ccc(F)cc3)c2)n1	CHEMBL2206912	=	5.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(Cl)c(N)c2)n1	CHEMBL2206911	=	324.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646565	=	155.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646566	=	369.0	2014	CHEMBL3638541
CC(=O)Nc1ccc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1	CHEMBL3646567	=	103.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@@H](O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1.COc1ccc(Nc2ncc([C@H](O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646568	=	33.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170083	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170089	=	3.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170088	=	1.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3357868	=	4.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCOCC3)cc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646569	=	32.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCOCC3)cc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3649480	=	17.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)(C)N)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646570	=	56.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)N)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646571	=	45.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)(C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646572	=	11.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170090	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)N3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646573	=	6.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C3(N4CCN(S(C)(=O)=O)CC4)CC3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646574	=	7.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)N3CCN(S(C)(=O)=O)CC3)nc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646575	=	3.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)O)nc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646576	=	31.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)=O)nc2-c2cc(N)nc(C)n2)cn1	CHEMBL3646577	=	103.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)N3CCN(S(C)(=O)=O)CC3)nc2-c2cc(N)nc(C)n2)cn1	CHEMBL3646578	=	11.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cnc2Nc2cc(F)c3cccnc3c2)n1	CHEMBL3646579	=	20.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)N3CCOCC3)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646580	=	45.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)N3CCN(C(=O)N(C)C)CC3)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646581	=	60.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)N3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646582	=	24.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646583	=	37.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3649481	=	44.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cnc2Nc2ccc3scnc3c2)n1	CHEMBL3646584	=	4.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)N3CCN(C(=O)N(C)C)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646585	=	12.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc3[nH]cnc23)cc1F	CHEMBL3646586	=	3.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc3[nH]cnc23)cc1F	CHEMBL3646587	=	18.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc3[nH]cnc23)cc1F	CHEMBL3646588	=	1.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C3(O)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3357869	=	4.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)NC(C)C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646589	=	61.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C3(N)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646590	=	74.0	2014	CHEMBL3638541
CCC(N)(CC)c1cnc(Nc2cnc(OC)c(F)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3646591	=	110.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cc1C(C)C	CHEMBL3646592	=	24.0	2014	CHEMBL3638541
CCS(=O)(=O)c1cnc(Nc2cnc(OC)c(F)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3646593	=	807.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL3646594	=	29.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646595	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646596	=	1.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2nccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL3646597	=	260.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)N3CC(S(C)(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646598	=	19.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc(Cl)nc2)n1	CHEMBL3646599	=	44.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3cccnc3c2)n1	CHEMBL3646600	=	36.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)CO)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3357872	=	8.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)CO)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646601	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)CO)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646601	=	9.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)CO)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646601	=	7.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)CC3C(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646603	=	7.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3357867	=	17.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCOC[C@@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646604	=	27.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170082	=	2.0	2014	CHEMBL3638541
COc1cc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cnc1Cl	CHEMBL3646605	=	18.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)C[C@@H]3C)cnc2Nc2ccc(Cl)nc2)n1	CHEMBL3646606	=	32.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646607	=	21.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(C)(O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646608	=	124.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(N3CCN(S(C)(=O)=O)CC3)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646609	=	34.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@@H](O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646610	=	86.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc([C@H](O)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3649482	=	34.0	2014	CHEMBL3638541
COc1ccc(Nc2ncc(C(N)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646611	=	59.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(N3CCN(S(C)(=O)=O)CC3)C(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646612	=	6.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCN(S(C)(=O)=O)CC3)cnc2Nc2ccc3ccncc3c2)n1	CHEMBL3646613	=	68.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)N)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646614	=	69.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL2206907	=	2.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O	CHEMBL2206920	=	10.0	2014	CHEMBL3638541
COc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2206903	=	7.0	2014	CHEMBL3638541
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2206904	=	14.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(CN3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL2206908	=	4.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@@H]3C(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F.COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)C[C@H]3C(F)(F)F)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646602	=	7.0	2014	CHEMBL3638541
COc1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N3CCOCC3)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2206905	=	11.0	2014	CHEMBL3638541
COCCOc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL2206906	=	5.0	2014	CHEMBL3638541
COCCOc1cnc(Nc2cnc(OC)c(NS(C)(=O)=O)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3646615	=	55.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1NS(C)(=O)=O	CHEMBL3646616	=	98.0	2014	CHEMBL3638541
Cc1nc(-c2cccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c2nc[nH]c2n1	CHEMBL3646617	=	5.0	2014	CHEMBL3638541
Cc1nc(-c2cc(C(C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c2nc[nH]c2n1	CHEMBL3646618	=	3.0	2014	CHEMBL3638541
Cc1nc(-c2cc(C(C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c2nc[nH]c2n1	CHEMBL3646619	=	4.0	2014	CHEMBL3638541
COc1cc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)CC3)cc2-c2nc(C)nc(N)n2)cnc1Cl	CHEMBL3646620	=	19.0	2014	CHEMBL3638541
COc1cc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)cnc1Cl	CHEMBL3646621	=	25.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C3=CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646622	=	5.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C3CCOCC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646623	=	5.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)O)cc2-c2cc(N)nc(C)n2)cc1F	CHEMBL3646624	=	13.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)C(=O)O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646625	=	377.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(O)C(C)(C)O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646626	=	75.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)cc1C(F)(F)F	CHEMBL3357876	=	207.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646627	=	59.0	2014	CHEMBL3638541
COc1cc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)cnc1OC	CHEMBL3358287	=	19.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(OC(=O)c3cccc(Cl)c3)C(C)(C)O)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646628	=	9.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)(C)O)cnc2Nc2cncc(F)c2)n1	CHEMBL3357874	=	23.0	2014	CHEMBL3638541
COc1cncc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)c1	CHEMBL3358288	=	15.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(C(C)(C)O)cc2-c2nc(C)nc(N)n2)cc1C	CHEMBL3357875	=	12.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)(C)O)cnc2Nc2cncc(S(C)(=O)=O)c2)n1	CHEMBL3358285	=	191.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)(C)O)cnc2Nc2cncc(S(=O)(=O)c3ccccc3)c2)n1	CHEMBL3358286	=	58.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(C(=O)N(C)C(C)C)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646629	=	14.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(C(=O)N(C)CC(F)(F)F)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646630	=	24.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(C(=O)N(C)C4CC4)CC3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646631	=	45.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170086	=	11.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@H](C)N3CCN(S(C)(=O)=O)C[C@H]3C)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL2170087	=	24.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cc2-c2nc(C)nc(N)n2)cn1	CHEMBL3646632	=	2.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCN(S(C)(=O)=O)C[C@@H]3C)cnc2Nc2ccc(Cl)nc2)n1	CHEMBL3646633	=	15.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN(S(C)(=O)=O)[C@H](C)C3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3646634	=	5.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(Cl)c(NS(=O)(=O)C3CC3)c2)n1	CHEMBL2206914	=	6.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(Cl)c(NS(=O)(=O)N3CCOCC3)c2)n1	CHEMBL2206917	=	14.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C(C)C)c2)n1	CHEMBL2206916	=	44.0	2014	CHEMBL3638541
COc1cnc(Nc2cnc(Cl)c(N)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3646635	=	270.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL3646636	=	8.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(C(C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649462	=	10.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL3649463	=	7.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)n1	CHEMBL3649464	=	5.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649465	=	6.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc([C@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649466	=	15.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cccnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649467	=	152.0	2014	CHEMBL3638541
COCCOc1cnc(Nc2cnc(C)c(NS(C)(=O)=O)c2)c(-c2nc(C)nc(N)n2)c1	CHEMBL3649468	=	71.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cccnc2Nc2cnc(C)c(NS(C)(=O)=O)c2)n1	CHEMBL3649469	=	279.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(Cl)cnc2Nc2cnc(C)c(NS(C)(=O)=O)c2)n1	CHEMBL2206919	=	85.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cc(C(C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649470	=	12.0	2014	CHEMBL3638541
C=Cc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(-c2cc(N)nc(C)n2)c1	CHEMBL3649471	=	59.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cc([C@@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649472	=	18.0	2014	CHEMBL3638541
Cc1nc(N)cc(-c2cc([C@H](C)N3CCOCC3)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL3649473	=	15.0	2014	CHEMBL3638541
COc1ncc(Nc2ncc(CN3CCN4C(CCS4(=O)=O)C3)cc2-c2nc(C)nc(N)n2)cc1F	CHEMBL3649474	=	7.0	2014	CHEMBL3638541
Cc1nc(N)nc(-c2cc(Cl)cnc2Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)n1	CHEMBL2206921	=	2.0	2014	CHEMBL3638541
COc1ccc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)C#N)cc5)c4c3n2)cn1	CHEMBL3681054	=	1.86	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(-c2ccc(C(C)(C)C#N)cc2)c(=O)n4C)cn1	CHEMBL3681055	=	34.8	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)C#N)cc5)c4c3n2)cn1	CHEMBL3681056	=	3.85	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(-c2ccc(C(C)(C)C#N)cc2)c(=O)n4C)cn1	CHEMBL3681057	=	4.45	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)C#N)cc5)c4c3n2)cc1F	CHEMBL3681058	=	3.81	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(-c2ccc(C(C)(C)C#N)cc2)c(=O)n4C)cc1F	CHEMBL3681059	=	2.35	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)C#N)cc5)c4c3n2)cn1	CHEMBL3681060	=	11.4	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(-c2ccc(C(C)(C)C#N)cc2)c(=O)n4C)cn1	CHEMBL3681061	=	6.09	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4[nH]c(=O)n(-c5ccc(C(C)(C)C#N)cc5)c4c3n2)cn1	CHEMBL3681062	=	59.2	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n(-c2ccc(C(C)(C)C#N)cc2)c(=O)n4C)cn1	CHEMBL3681063	=	72.3	2014	CHEMBL3639366
O=C(OCc1ccccc1)C1CCC(n2c(=O)[nH]c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681064	=	7.77	2014	CHEMBL3639366
Cn1c(=O)n(C2CCC(C(=O)OCc3ccccc3)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681065	=	2.91	2014	CHEMBL3639366
O=c1[nH]c2cnc3ccc(-c4cnc5ccccc5c4)nc3c2n1C1CCNCC1	CHEMBL3681066	=	2.43	2014	CHEMBL3639366
CCN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681067	=	3.19	2014	CHEMBL3639366
CCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681068	=	0.539	2014	CHEMBL3639366
COC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681069	=	0.806	2014	CHEMBL3639366
CNC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681070	=	1.96	2014	CHEMBL3639366
CC(C)C(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681072	=	1.06	2014	CHEMBL3639366
CN(C)CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681073	=	2.55	2014	CHEMBL3639366
CCOC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681074	=	1.38	2014	CHEMBL3639366
CC(C)OC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681075	=	2.89	2014	CHEMBL3639366
CN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681076	=	5.92	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4[nH]c(=O)n(Cc5ccccc5)c4c3n2)cn1	CHEMBL3681077	=	2.39	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4[nH]c(=O)n([C@H]5CC[C@H](OCCO)CC5)c4c3n2)cn1	CHEMBL3681078	=	0.644	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4[nH]c(=O)n([C@H]5CC[C@H](O)CC5)c4c3n2)cn1	CHEMBL3681079	=	0.51	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](OCCO)CC2)c(=O)n4C)cn1	CHEMBL2331658	=	0.5	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](O)CC2)c(=O)n4C)cn1	CHEMBL2331659	=	0.5	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cn1	CHEMBL2331661	=	0.478	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681080	=	3.48	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CN(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681081	=	2.23	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681082	=	0.339	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1	CHEMBL3681083	=	0.668	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(CC(F)(F)F)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681084	=	20.5	2014	CHEMBL3639366
CNC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(OC)nc5)nc4c32)CC1	CHEMBL3681085	=	1.15	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)C(C)(C)O)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681086	=	0.568	2014	CHEMBL3639366
CN(C)CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681087	=	2.1	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)C(C)(C)N)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681088	=	3.92	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681089	=	1.2	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](OCCO)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21	CHEMBL3681090	=	1.08	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](OCCO)CC2)c(=O)n4C)cn1	CHEMBL3681091	=	2.09	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](OCCO)CC2)c(=O)n4C)cn1	CHEMBL3639799	=	0.102	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(F)(F)F)CC2)c(=O)n4C)cn1	CHEMBL3681092	=	8.78	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](OCCO)CC2)c(=O)n4C)cn1	CHEMBL3681094	=	1.68	2014	CHEMBL3639366
COCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(C)nc5)nc4c32)CC1	CHEMBL2331666	=	0.922	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)[C@H](C)O)CC2)c(=O)n4C)cn1	CHEMBL3681095	=	2.59	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](C(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681096	=	3.0	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](C(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681097	=	23.3	2014	CHEMBL3639366
COCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc(OC)nc5)nc4c32)CC1	CHEMBL3681098	=	4.97	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)C(C)(C)O)CC2)c(=O)n4C)cn1	CHEMBL2331665	=	3.89	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(=O)N(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681099	=	4.7	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](C(N)=O)CC2)c2c3nc(-c4cnn(CCO)c4)ccc3ncc21	CHEMBL3681100	=	16.2	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(c3ncccn3)CC2)c(=O)n4C)cn1	CHEMBL3681101	=	3.52	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CCO)CC2)c(=O)n4C)cn1	CHEMBL3681102	=	1.77	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cn[nH]c4)ccc3ncc21	CHEMBL3681103	=	4.17	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](O)CC2)c(=O)n4C)cn1	CHEMBL3681104	=	0.974	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](O)CC2)c(=O)n4C)cn1	CHEMBL3681105	=	7.44	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C)CC2)c(=O)n4C)cn1	CHEMBL3681106	=	4.26	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CO)CC2)c(=O)n4C)cn1	CHEMBL2331663	=	0.532	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(C)nc5)nc4c32)CC1	CHEMBL2331662	=	1.97	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cc[nH]n4)ccc3ncc21	CHEMBL3681107	=	23.3	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681108	=	0.882	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CN(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681109	=	4.09	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n([C@H]2CC[C@H](O)CC2)c(=O)n4C)cn1	CHEMBL3681110	=	1.03	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CN)CC2)c(=O)n4C)cn1	CHEMBL3681111	=	0.32	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)NN)CC2)c(=O)n4C)cn1	CHEMBL3681112	=	3.27	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(C)CC2)c(=O)n4C)cn1	CHEMBL3681113	=	27.5	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CN(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681114	=	28.7	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CN)CC2)c(=O)n4C)cn1	CHEMBL3681115	=	3.93	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(CCO)CC2)c(=O)n4C)cn1	CHEMBL3681116	=	11.9	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cn1	CHEMBL3681117	=	3.87	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCNCC2)c(=O)n4C)cn1	CHEMBL3681118	=	8.15	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCNCC2)c(=O)n4C)cn1	CHEMBL3681119	=	0.5	2014	CHEMBL3639366
N[C@H]1CC[C@H](n2c(=O)[nH]c3cnc4ccc(-c5cnc6ccccc6c5)nc4c32)CC1	CHEMBL3681120	=	2.21	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681121	=	0.391	2014	CHEMBL3639366
CNC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681122	=	0.76	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681123	=	1.05	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(CCO)CC2)c(=O)n4C)cn1	CHEMBL3681124	=	3.13	2014	CHEMBL3639366
Cn1c(=O)n(C2CCOCC2)c2c3nc(-c4cn[nH]c4)ccc3ncc21	CHEMBL3681125	=	11.3	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1	CHEMBL3681126	=	1.11	2014	CHEMBL3639366
COc1ncc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1	CHEMBL3681127	=	8.96	2014	CHEMBL3639366
Cn1c(=O)n(C2CCOCC2)c2c3nc(-c4cc[nH]n4)ccc3ncc21	CHEMBL3681128	=	28.3	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1	CHEMBL3681129	=	5.17	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1	CHEMBL3681130	=	0.298	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)C(C)(C)C)CC2)c(=O)n4C)cn1	CHEMBL3681131	=	0.281	2014	CHEMBL3639366
COCCN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681132	=	0.802	2014	CHEMBL3639366
CN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681133	=	26.7	2014	CHEMBL3639366
Cn1c(=O)n(C2CCOCC2)c2c3nc(-c4cnn(CCO)c4)ccc3ncc21	CHEMBL3681134	=	24.4	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)C(C)(C)O)CC2)c(=O)n4C)cn1	CHEMBL3681135	=	0.264	2014	CHEMBL3639366
Cn1c(=O)n(C2CCOCC2)c2c3nc(-c4cnc(N)nc4)ccc3ncc21	CHEMBL3681136	=	0.529	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n(C2CCN(CC(N)=O)CC2)c(=O)n4C)cn1	CHEMBL3681137	=	4.63	2014	CHEMBL3639366
CC(C)C(=O)CN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnn(C)c5)nc4c32)CC1	CHEMBL3681138	=	14.7	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnn(C)c5)nc4c32)CC1	CHEMBL3681139	=	4.09	2014	CHEMBL3639366
C[C@@H](O)C(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N(C)C)nc5)nc4c32)CC1	CHEMBL3681140	=	0.397	2014	CHEMBL3639366
Cn1cc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)C(C)(C)O)CC2)c(=O)n4C)cn1	CHEMBL3681141	=	4.67	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CO)CC2)c(=O)n4C)cn1	CHEMBL3681142	=	0.505	2014	CHEMBL3639366
CNC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnn(C)c5)nc4c32)CC1	CHEMBL3681143	=	26.2	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4CCO)cn1	CHEMBL3681144	=	45.4	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4CCO)cn1	CHEMBL3681145	=	75.7	2014	CHEMBL3639366
CN(C)c1ccc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4CCO)cn1	CHEMBL3681148	=	319.0	2014	CHEMBL3639366
Cn1c(=O)n(C2CCNCC2)c2c3nc(-c4cnn(CCO)c4)ccc3ncc21	CHEMBL3681152	=	52.1	2014	CHEMBL3639366
Cn1c(=O)n(C2CCNCC2)c2c3nc(-c4cnc(N)nc4)ccc3ncc21	CHEMBL3681153	=	1.61	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cnc(N)nc4)ccc3ncc21	CHEMBL3681154	=	0.273	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n([C@H](C)CO)c(=O)n4C)cn1	CHEMBL3681155	=	13.4	2014	CHEMBL3639366
C[C@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4cnn(C)c4)nc3c21	CHEMBL3681156	=	143.0	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n([C@H](C)CO)c(=O)n4C)cn1	CHEMBL3681157	=	8.94	2014	CHEMBL3639366
C[C@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4cnc5ccccc5c4)nc3c21	CHEMBL3681158	=	57.3	2014	CHEMBL3639366
C[C@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4cnc(N)nc4)nc3c21	CHEMBL3681159	=	15.5	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cccc5[nH]ccc45)ccc3ncc21	CHEMBL3681160	=	4.41	2014	CHEMBL3639366
C[C@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4cccc5[nH]ccc45)nc3c21	CHEMBL3681161	=	29.6	2014	CHEMBL3639366
C[C@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4c[nH]c5nncc-5c4)nc3c21	CHEMBL3681162	=	0.438	2014	CHEMBL3639366
C[C@@H](CO)n1c(=O)n(C)c2cnc3ccc(-c4cnn(C)c4)nc3c21	CHEMBL3681163	=	102.0	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n([C@@H](C)CO)c(=O)n4C)cn1	CHEMBL3681164	=	4.08	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(N)nc5)nc4c32)CC1	CHEMBL3681165	=	0.252	2014	CHEMBL3639366
CNC(=O)Nc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)[C@H](C)O)CC2)c(=O)n4C)cc1	CHEMBL3681166	=	1.94	2014	CHEMBL3639366
CNC(=O)Nc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CO)CC2)c(=O)n4C)cc1	CHEMBL3681167	=	2.19	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccc(S(C)(=O)=O)cc5)nc4c32)CC1	CHEMBL3681168	=	24.2	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cccc(-n6cccn6)c5)nc4c32)CC1	CHEMBL3681169	=	17.6	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccnc6ncccc56)nc4c32)CC1	CHEMBL3681170	=	4.51	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccnc6[nH]ncc56)nc4c32)CC1	CHEMBL3681171	=	0.811	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)CO)CC2)c2c3nc(-c4ccnc5[nH]ncc45)ccc3ncc21	CHEMBL3681172	=	0.832	2014	CHEMBL3639366
C[C@H](O)C(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5ccnc6[nH]ncc56)nc4c32)CC1	CHEMBL3681173	=	1.04	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cccc6[nH]ncc56)nc4c32)CC1	CHEMBL2331667	=	0.513	2014	CHEMBL3639366
C[C@H](O)C(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cccc6[nH]ncc56)nc4c32)CC1	CHEMBL2331669	=	0.721	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)CO)CC2)c2c3nc(-c4cccc5[nH]ncc45)ccc3ncc21	CHEMBL3681174	=	0.575	2014	CHEMBL3639366
Cc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)[C@H](C)O)CC2)c(=O)n4C)cn1	CHEMBL2331664	=	0.958	2014	CHEMBL3639366
C[C@@H](O)C(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6[nH]ncc6c5)nc4c32)CC1	CHEMBL3681175	=	0.11	2014	CHEMBL3639366
CC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6[nH]ncc6c5)nc4c32)CC1	CHEMBL2331668	=	0.191	2014	CHEMBL3639366
COCC(=O)N1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6[nH]ncc6c5)nc4c32)CC1	CHEMBL3681176	=	0.167	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)C(C)(C)O)CC2)c2c3nc(-c4cnc5[nH]ncc5c4)ccc3ncc21	CHEMBL3681177	=	0.114	2014	CHEMBL3639366
Cn1c(=O)n(C2CCN(C(=O)CO)CC2)c2c3nc(-c4cnc5[nH]ncc5c4)ccc3ncc21	CHEMBL3681178	=	0.32	2014	CHEMBL3639366
CN1CCC(n2c(=O)n(C)c3cnc4ccc(-c5cnc6[nH]ncc6c5)nc4c32)CC1	CHEMBL3681179	=	0.282	2014	CHEMBL3639366
CCNC(=O)Nc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n4C)cc1	CHEMBL3681180	=	5.02	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(CCN2CCNCC2)c(=O)n4C)cn1	CHEMBL3681181	=	7.8	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4ccc5[nH]ncc5c4)ccc3ncc21	CHEMBL3681182	=	0.145	2014	CHEMBL3639366
Cn1c(=O)n([C@H]2CC[C@H](O)CC2)c2c3nc(-c4cnc5[nH]ncc5c4)ccc3ncc21	CHEMBL3681183	=	0.366	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(CCN2CCOCC2)c(=O)n4C)cn1	CHEMBL3681184	=	12.2	2014	CHEMBL3639366
COCCn1c(=O)n(C)c2cnc3ccc(-c4ccc(OC)nc4)nc3c21	CHEMBL3681185	=	13.5	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)[C@H](C)O)CC2)c(=O)n4C)cc1	CHEMBL3681187	=	1.84	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CO)CC2)c(=O)n4C)cc1	CHEMBL3681188	=	1.94	2014	CHEMBL3639366
COc1ccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)cc1	CHEMBL3681189	=	7.71	2014	CHEMBL3639366
COc1cccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)[C@H](C)O)CC2)c(=O)n4C)c1	CHEMBL3681190	=	2.01	2014	CHEMBL3639366
COc1cccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(=O)CO)CC2)c(=O)n4C)c1	CHEMBL3639800	=	2.22	2014	CHEMBL3639366
COc1cccc(-c2ccc3ncc4c(c3n2)n(C2CCN(C(C)=O)CC2)c(=O)n4C)c1	CHEMBL3681191	=	3.04	2014	CHEMBL3639366
COc1ccccc1-c1ccc2ncc3c(c2n1)n(C1CCN(C(=O)CO)CC1)c(=O)n3C	CHEMBL3681192	=	118.0	2014	CHEMBL3639366
COc1ccccc1-c1ccc2ncc3c(c2n1)n(C1CCN(C(=O)CO)CC1)c(=O)n3C	CHEMBL3681192	=	292.0	2014	CHEMBL3639366
COc1cc(-c2cnc3ccc(N4C(=O)OC[C@H]4Cc4ccccc4)cn23)cnc1OC	CHEMBL3649433	=	268.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccc(N4C(=O)OC[C@@H]4Cc4ccccc4)cn23)cnc1OC	CHEMBL3649434	=	286.0	2014	CHEMBL3639163
COc1cc(-c2cnc3ccc(N4CCOCC4)cn23)cnc1OC	CHEMBL3649435	=	1077.0	2014	CHEMBL3639163
O=c1n(Cc2ccccc2)ccc2ncc(-c3cnc(Cl)c(NS(=O)(=O)c4ccc(F)cc4)c3)n12	CHEMBL3649444	=	465.0	2014	CHEMBL3639163
CN(C)S(=O)(=O)Nc1cc(-c2cnc3ccc(-c4ccncc4)cn23)cnc1Cl	CHEMBL3649445	=	1.0	2014	CHEMBL3639163
CN(C)S(=O)(=O)Nc1cc(-c2cnc3ccc(-c4ccnc(C(F)(F)F)c4)cn23)cnc1Cl	CHEMBL3649436	=	1.0	2014	CHEMBL3639163
CS(=O)(=O)Nc1cc(-c2cnc3cc(-c4cccnc4)ccn23)cnc1Cl	CHEMBL3649437	=	5.0	2014	CHEMBL3639163
CN(C)S(=O)(=O)Nc1cc(-c2cnc3cc(-c4ccncc4)ccn23)cnc1Cl	CHEMBL3649438	=	15.0	2014	CHEMBL3639163
CN(C)S(=O)(=O)Nc1cc(-c2cnc3cc(-c4cccnc4)ccn23)cnc1Cl	CHEMBL3649439	=	21.0	2014	CHEMBL3639163
Cc1cc2ncc(-c3cnc(Cl)c(NS(=O)(=O)N(C)C)c3)n2cc1-c1ccncc1	CHEMBL3649446	=	4.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ncccn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649447	=	378.0	2014	CHEMBL3639163
O=S(=O)(Nc1cc(-c2cnc3ccc(Cl)nn23)cnc1Cl)c1ccc(F)cc1	CHEMBL3649440	=	22.0	2014	CHEMBL3639163