canonical_smiles compound_chembl_id standard_relation standard_value publication_year document_chembl_id O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2ccccc2)[nH]n1 CHEMBL3663679 = 4.3 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1F)c1n[nH]c2cc(F)ccc12 CHEMBL3672946 = 5.1 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1n[nH]c2cc(F)ccc12 CHEMBL3672947 = 0.9 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3672948 = 1.5 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 CHEMBL3672949 = 2.8 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc(C3CNCCO3)cc2Cl)c1 CHEMBL3672950 = 1.3 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)c1 CHEMBL3677871 = 1.7 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2Cl)c1 CHEMBL3672951 = 1.6 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3672952 = 3.9 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3672953 = 10.5 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)nc1)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3672954 = 3.3 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)nc1)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3672955 = 9.5 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)cc1F)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3672956 = 0.6 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3672957 = 2.4 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc(C2CNCCO2)cc1Cl CHEMBL3672958 = 3.9 2015 CHEMBL3638970 N#Cc1cccc(CNC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3672959 = 54.4 2015 CHEMBL3638970 N#Cc1cccc(CNC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 CHEMBL3672960 = 67.9 2015 CHEMBL3638970 Cn1nc(-c2ccccc2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3672961 = 12.8 2015 CHEMBL3638970 O=C(Nc1ccc(C2CNCCO2)cc1Cl)c1cnn(-c2ccc(F)cc2)c1 CHEMBL3672962 = 3.3 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3677872 = 3.4 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672963 = 5.0 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)cc1F)c1cnn(-c2ccc(F)cc2)c1 CHEMBL3672964 = 2.2 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cnn(-c2ccc(F)cc2)c1 CHEMBL3672965 = 3.6 2015 CHEMBL3638970 Cn1nc(-c2ccccc2)cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3672966 = 3.3 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)cc(Cl)n1 CHEMBL3672967 = 7.0 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(Cl)n1 CHEMBL3672968 = 12.7 2015 CHEMBL3638970 N#Cc1cc(F)cc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 CHEMBL3672969 = 2.0 2015 CHEMBL3638970 N#Cc1cc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)ccc1F CHEMBL3672970 = 3.8 2015 CHEMBL3638970 N#Cc1cc(C2CNCCO2)ccc1NC(=O)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3672971 = 5.9 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3672972 = 3.6 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)cc1Cl)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3672973 = 1.2 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1cnn(-c2ccc(F)cc2)c1 CHEMBL3639718 = 1.2 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)cc1Cl)c1cnn(-c2ccc(F)cc2)c1 CHEMBL3672974 = 1.2 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc(C3CNCCO3)cc2C#N)c1 CHEMBL3672975 = 1511.2 2015 CHEMBL3638970 O=C(Nc1ccc(C2CNCCO2)cc1Cl)c1ccc(Cl)cc1 CHEMBL3672976 = 22.9 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)cc1Cl)c1ccc(Cl)nc1 CHEMBL3672977 = 110.9 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1ccc(Cl)nc1 CHEMBL3672978 = 488.3 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc(C2CNCCO2)cc1Br CHEMBL3672979 = 5.3 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc(C2CCNC2)cc1Cl CHEMBL3672980 = 19.1 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3672981 = 8.5 2015 CHEMBL3638970 Cc1cc([C@@H]2CNCCO2)ccc1NC(=O)Nc1ccc(Cl)nc1 CHEMBL3672982 = 120.4 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc(C2CCCNC2)cc1Cl CHEMBL3672983 = 9.0 2015 CHEMBL3638970 Cc1cc([C@@H]2CNCCO2)ccc1NC(=O)c1ccc(Cl)nc1 CHEMBL3672984 = 3989.0 2015 CHEMBL3638970 O=C(Nc1ccc(C2CCCNC2)cc1Cl)c1ccc(Cl)nc1 CHEMBL3672985 = 367.2 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3672986 = 5.9 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672987 = 4.4 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3672988 = 6.4 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2Cl)c1 CHEMBL3672989 = 1.2 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)c1 CHEMBL3672990 = 1.8 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)nc1)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672991 = 1.5 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)nc1)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3672992 = 1.4 2015 CHEMBL3638970 O=C(Nc1cnc(C(F)(F)F)nc1)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3672993 = 12.6 2015 CHEMBL3638970 O=C(Nc1cnc(C(F)(F)F)nc1)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672994 = 5.8 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)cn1)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3672995 = 1.7 2015 CHEMBL3638970 O=C(Nc1ccc(C(F)(F)F)cn1)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672996 = 1.8 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)cn1)Nc1ccc([C@@H]2CNCCO2)cc1Cl CHEMBL3672997 = 1.4 2015 CHEMBL3638970 N#Cc1ccc(F)c(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3672998 = 3.5 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1Br CHEMBL3672999 = 12.7 2015 CHEMBL3638970 COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H]2CNCCO2)cc1Br CHEMBL3673000 = 16.1 2015 CHEMBL3638970 N#Cc1cc(F)cc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3673001 = 1.0 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2Br)c1 CHEMBL3673002 = 1.0 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2Br)c1 CHEMBL3673003 = 2.5 2015 CHEMBL3638970 N#Cc1cccc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1F CHEMBL3673004 = 2.8 2015 CHEMBL3638970 N#Cc1cc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)ccc1F CHEMBL3673005 = 0.7 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)cn1)Nc1ccc([C@H]2CNCCO2)cc1Cl CHEMBL3673006 = 3.0 2015 CHEMBL3638970 N#Cc1ccc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2Br)cn1 CHEMBL3673007 = 21.8 2015 CHEMBL3638970 N#Cc1ccc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2Br)cn1 CHEMBL3673008 = 16.1 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@@H]2CNCCO2)cc1Br CHEMBL3673009 = 3.8 2015 CHEMBL3638970 O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@H]2CNCCO2)cc1Br CHEMBL3673010 = 8.1 2015 CHEMBL3638970 O=C(Nc1cnc(C(F)(F)F)nc1)Nc1ccc([C@H]2CNCCO2)cc1Br CHEMBL3673011 = 18.0 2015 CHEMBL3638970 O=C(Nc1cnc(C(F)(F)F)nc1)Nc1ccc([C@@H]2CNCCO2)cc1Br CHEMBL3673012 = 10.3 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 CHEMBL3673013 = 1.2 2015 CHEMBL3638970 N#Cc1ccc(OC(F)F)c(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3673014 = 1.0 2015 CHEMBL3638970 CCOc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3673015 = 1.9 2015 CHEMBL3638970 CCOc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3673016 = 3.9 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cnn(-c2cccc(OC(F)F)c2)c1 CHEMBL3673017 = 1.1 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cnn(-c2ccc(OC(F)F)cc2)c1 CHEMBL3673018 = 1.8 2015 CHEMBL3638970 O=C(NCc1cccc(OC(F)F)c1)Nc1ccc([C@@H]2CNCCO2)cc1F CHEMBL3673019 = 6.4 2015 CHEMBL3638970 O=C(NCc1cccc(OC(F)F)c1)Nc1ccc([C@H]2CNCCO2)cc1F CHEMBL3673020 = 3.9 2015 CHEMBL3638970 N#Cc1ccnc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 CHEMBL3673021 = 196.3 2015 CHEMBL3638970 N#Cc1ccnc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 CHEMBL3673022 = 32.5 2015 CHEMBL3638970 N#Cc1cccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)n1 CHEMBL3673023 = 959.3 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cnn(-c2ccc3c(c2)OC(F)(F)O3)c1 CHEMBL3673024 = 1.6 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)c(F)c1)c1ccnc(C(F)(F)F)c1 CHEMBL3673025 = 7.5 2015 CHEMBL3638970 CCOc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)c(F)c2)ccn1 CHEMBL3673026 = 4.7 2015 CHEMBL3638970 CCOc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)c(F)c2)cn1 CHEMBL3673027 = 6.7 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)c(F)c1)c1cnn(-c2ccc(OC(F)F)cc2)c1 CHEMBL3673028 = 0.7 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1ccnc(C(F)(F)F)c1 CHEMBL3673029 = 20.2 2015 CHEMBL3638970 CCOc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)ccn1 CHEMBL3673030 = 45.8 2015 CHEMBL3638970 CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cn1 CHEMBL3673031 = 25.4 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2ccc(OC(F)F)cc2)c1 CHEMBL3673032 = 0.7 2015 CHEMBL3638970 CCOc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)c(Cl)c2)ccn1 CHEMBL3673033 = 3.0 2015 CHEMBL3638970 CCOc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)c(Cl)c2)cn1 CHEMBL3673034 = 4.5 2015 CHEMBL3638970 O=C(Nc1ccc([C@@H]2CNCCO2)c(Cl)c1)c1cnn(-c2ccc(OC(F)F)cc2)c1 CHEMBL3673035 = 1.2 2015 CHEMBL3638970 CCOc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)ccn1 CHEMBL3673036 = 38.1 2015 CHEMBL3638970 CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)cn1 CHEMBL3673037 = 35.0 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(Cl)c1)c1cnn(-c2ccc(OC(F)F)cc2)c1 CHEMBL3673038 = 0.6 2015 CHEMBL3638970 N#Cc1cccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2Cl)n1 CHEMBL3673039 = 184.0 2015 CHEMBL3638970 N#Cc1cccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)n1 CHEMBL3673040 = 565.0 2015 CHEMBL3638970 N#Cc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)nc1 CHEMBL3673041 = 154.4 2015 CHEMBL3638970 N#Cc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2Cl)nc1 CHEMBL3673042 = 20.2 2015 CHEMBL3638970 N#Cc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)cn1 CHEMBL3673043 = 524.0 2015 CHEMBL3638970 N#Cc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2Cl)cn1 CHEMBL3673044 = 409.9 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3Cl)cn2)cc1 CHEMBL3673045 = 3.1 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cn(-c2ccc(OC(F)F)cc2)nn1 CHEMBL3673046 = 34.0 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)c(Cl)c3)cn2)cc1 CHEMBL3673047 = 2.7 2015 CHEMBL3638970 N#Cc1cc(Cl)cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)n1 CHEMBL3673048 = 93.8 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cc(C#N)n1 CHEMBL3673049 = 6.5 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)c(F)c3)cn2)c(F)c1 CHEMBL3673050 = 5.9 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)c(Cl)c3)cn2)c(F)c1 CHEMBL3673051 = 3.8 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3F)cn2)c(F)c1 CHEMBL3673052 = 15.2 2015 CHEMBL3638970 N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3F)cn2)cc1 CHEMBL3673053 = 8.6 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)cc(C#N)n1 CHEMBL3673054 = 24.8 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(C#N)n1 CHEMBL3673055 = 65.4 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cc(C(N)=O)n1 CHEMBL3673056 = 265.4 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cc(C#N)n1 CHEMBL3673057 = 34.3 2015 CHEMBL3638970 NC(=O)c1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cc(Cl)n1 CHEMBL3673058 = 162.3 2015 CHEMBL3638970 CCc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)cc(C(N)=O)n1 CHEMBL3673059 = 45.0 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)cc(C(N)=O)n1 CHEMBL3673060 = 263.6 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(C(N)=O)n1 CHEMBL3673061 = 686.8 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(C(N)=O)n1 CHEMBL3673062 = 425.6 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cc(C#N)n1 CHEMBL3673063 = 15.8 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)cc(C(N)=O)n1 CHEMBL3673064 = 758.0 2015 CHEMBL3638970 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)cc(C#N)n1 CHEMBL3673065 = 47.4 2015 CHEMBL3638970 COc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2Cl)cc(C#N)n1 CHEMBL3673066 = 23.1 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1F)c1cnn(-c2cncc(C(F)(F)F)n2)c1 CHEMBL3673067 = 7.6 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1cnn(-c2cncc(C(F)(F)F)n2)c1 CHEMBL3673068 = 4.7 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2cncc(C(F)(F)F)n2)c1 CHEMBL3677859 = 1.6 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(Cl)c1)c1cnn(-c2cncc(C(F)(F)F)n2)c1 CHEMBL3677860 = 2.5 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2cc(C(F)(F)F)ncn2)c1 CHEMBL3677861 = 2.5 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2ccc(C(F)(F)F)nc2)c1 CHEMBL3677862 = 3.8 2015 CHEMBL3638970 N#Cc1cnc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)c(F)c3)cn2)cn1 CHEMBL3677863 = 14.4 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2ccnc(C(F)(F)F)n2)c1 CHEMBL3677864 = 3.6 2015 CHEMBL3638970 N#Cc1cc(Cl)cc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)n1 CHEMBL3677865 = 18.0 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnn(-c2cnc(C(F)(F)F)cn2)c1 CHEMBL3677866 = 4.0 2015 CHEMBL3638970 Cc1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)ccc1C#N CHEMBL3677867 = 578.3 2015 CHEMBL3638970 Cc1nc(C(=O)Nc2ccc([C@H]3CNCCO3)c(F)c2)ccc1C#N CHEMBL3677868 = 58.5 2015 CHEMBL3638970 O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1cnc(C(F)(F)F)cn1 CHEMBL3677869 = 30.1 2015 CHEMBL3638970 CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2F)cn1 CHEMBL3677870 = 308.2 2015 CHEMBL3638970 NC1=N[C@@H](CCc2ccc(Nc3cccc4cccnc34)cc2)CO1 CHEMBL3656474 = 0.6 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cccc4ccccc34)cc2)CO1 CHEMBL3656475 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(F)cn3)cc2)CO1 CHEMBL3656476 = 0.2 2014 CHEMBL3638821 Cc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)c2ncccc2c1 CHEMBL3656477 = 0.6 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cccc4cccc(Cl)c34)cc2)CO1 CHEMBL3656478 = 3.3 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(Cl)cc3)cc2)CO1 CHEMBL3656479 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(Cl)cc3F)cc2)CO1 CHEMBL3656480 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(C(F)(F)F)cc3)cc2)CO1 CHEMBL3656481 = 0.2 2014 CHEMBL3638821 COc1ccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)cc1 CHEMBL3656482 = 0.2 2014 CHEMBL3638821 Cc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)ccc1OC(F)(F)F CHEMBL3656483 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)CO1 CHEMBL3656484 = 0.4 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccccc3)cc2)CO1 CHEMBL3656486 = 0.1 2014 CHEMBL3638821 Cc1ccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)cc1 CHEMBL3656487 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(Cl)cn3)cc2)CO1 CHEMBL3656488 = 0.1 2014 CHEMBL3638821 N#Cc1ccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656489 = 0.4 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cc(C(F)(F)F)ncn3)cc2)CO1 CHEMBL3656490 = 1.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(Cl)cn3)cc2)CO1 CHEMBL3656491 = 0.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccc(Cl)c(Cl)c3)cc2)CO1 CHEMBL3656492 = 0.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(F)cn3)cc2)CO1 CHEMBL3656493 = 4.0 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncccc3F)cc2)CO1 CHEMBL3656494 = 0.5 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cc(F)ccn3)cc2)CO1 CHEMBL3656495 = 0.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cc(C(F)(F)F)ccn3)cc2)CO1 CHEMBL3656496 = 0.2 2014 CHEMBL3638821 Cc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)ncn1 CHEMBL3656497 = 1.3 2014 CHEMBL3638821 Cc1cccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656498 = 0.7 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cccc(C(F)(F)F)n3)cc2)CO1 CHEMBL3656499 = 0.8 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cncc(Cl)n3)cc2)CO1 CHEMBL3656500 = 4.0 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cccc(Cl)n3)cc2)CO1 CHEMBL3656501 = 0.5 2014 CHEMBL3638821 Cc1ccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656502 = 3.5 2014 CHEMBL3638821 COc1ccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656503 = 8.3 2014 CHEMBL3638821 N#Cc1cncc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656504 = 5.9 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cc(Cl)ncn3)cc2)CO1 CHEMBL3656505 = 0.8 2014 CHEMBL3638821 COc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)ncn1 CHEMBL3656506 = 2.3 2014 CHEMBL3638821 Cc1nccc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656507 = 2.6 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ccncn3)cc2)CO1 CHEMBL3656508 = 2.3 2014 CHEMBL3638821 COc1ccnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656509 = 0.4 2014 CHEMBL3638821 CCc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656510 = 1.2 2014 CHEMBL3638821 COc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656511 = 0.7 2014 CHEMBL3638821 N#Cc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)cn1 CHEMBL3656512 = 4.3 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3nccc(C(F)(F)F)n3)cc2)CO1 CHEMBL3656513 = 1.0 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3nccnc3Cl)cc2)CO1 CHEMBL3656514 = 3.1 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cc(C(F)(F)F)cc(Cl)n3)cc2)CO1 CHEMBL3656515 = 1.6 2014 CHEMBL3638821 Cc1cncc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656516 = 4.6 2014 CHEMBL3638821 COc1nc(Cl)cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656517 = 1.1 2014 CHEMBL3638821 CSc1ccnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656518 = 1.3 2014 CHEMBL3638821 Cc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656519 = 1.2 2014 CHEMBL3638821 CC(=O)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656520 = 2.4 2014 CHEMBL3638821 Cc1ccnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)n1 CHEMBL3656521 = 1.2 2014 CHEMBL3638821 CCCc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656522 = 0.6 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3cnc(Cl)nc3)cc2)CO1 CHEMBL3656523 = 0.6 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(Br)cn3)cc2)CO1 CHEMBL3656524 = 0.4 2014 CHEMBL3638821 C[C@@H]1OC(N)=N[C@H]1CCc1ccc(Nc2ncc(Cl)cn2)cc1 CHEMBL3656525 = 0.6 2014 CHEMBL3638821 CCC(=O)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656526 = 26.5 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(C4CC4)cn3)cc2)CO1 CHEMBL3656527 = 0.4 2014 CHEMBL3638821 CCOc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656528 = 8.3 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(C(F)(F)F)cn3)cc2)CO1 CHEMBL3656529 = 3.9 2014 CHEMBL3638821 CC(C)(C)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656530 = 0.4 2014 CHEMBL3638821 CCC(CC)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656531 = 0.1 2014 CHEMBL3638821 N#Cc1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656532 = 0.8 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(C4CCC4)cn3)cc2)CO1 CHEMBL3656533 = 0.2 2014 CHEMBL3638821 CC(C)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3656534 = 0.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3ccc(Br)cn3)C(F)(F)F)cc2)CO1 CHEMBL3656535 = 13.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3ccc(Cl)cc3)C(F)(F)F)cc2)CO1 CHEMBL3660699 = 2.2 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(N[C@@H](c3ccc(Cl)cc3)C(F)(F)F)cc2)CO1 CHEMBL3660700 = 2.0 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3cccc(F)c3)C(F)(F)F)cc2)CO1 CHEMBL3660701 = 6.4 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3ccc(C(F)(F)F)cc3)C(F)(F)F)cc2)CO1 CHEMBL3660702 = 8.4 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3ccc(Cl)cn3)C(F)(F)F)cc2)CO1 CHEMBL3660703 = 26.5 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(NC(c3cc(Cl)cc(Cl)c3)C(F)(F)F)cc2)CO1 CHEMBL3660704 = 40.7 2014 CHEMBL3638821 COc1cccc(C(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)C(F)(F)F)n1 CHEMBL3660705 = 20.5 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(Cl)cn3)nc2)CO1 CHEMBL3660706 = 1.1 2014 CHEMBL3638821 Cc1cc(CC[C@H]2COC(N)=N2)ccc1Nc1ncc(Cl)cn1 CHEMBL3660707 = 0.7 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(Nc3ncc(OCC(F)(F)F)cn3)cc2)CO1 CHEMBL3660708 = 2.8 2014 CHEMBL3638821 CS(=O)(=O)c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3660709 = 14.6 2014 CHEMBL3638821 C[S+]([O-])c1cnc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)nc1 CHEMBL3660710 = 104.4 2014 CHEMBL3638821 NC1=N[C@@H](CCc2ccc(N[C@H](c3ccc(Cl)cc3)C(F)(F)F)cc2)CO1 CHEMBL3660711 = 3.2 2014 CHEMBL3638821 CC1(c2cccc(Cl)c2F)COC(N)=N1 CHEMBL3684882 = 4.2 2013 CHEMBL3638700 NC1=N[C@@H](COc2cc(Cl)cc(Cl)c2)CO1 CHEMBL3684865 = 4.5 2013 CHEMBL3638700 CCC(C[C@H]1COC(N)=N1)c1cccc(Cl)c1 CHEMBL3684866 = 2.7 2013 CHEMBL3638700 NC1=N[C@@H](c2ccc(Br)c(F)c2)CO1 CHEMBL3684887 = 1.4 2013 CHEMBL3638700 NC1=N[C@@H](CCc2ccccc2Br)CO1 CHEMBL3684888 = 2.0 2013 CHEMBL3638700 NC1=N[C@@H](COc2ccc(Br)cc2)CO1 CHEMBL3684881 = 9.0 2013 CHEMBL3638700 CC[C@]1(c2ccc(Cl)cc2)COC(N)=N1 CHEMBL3684883 = 5.0 2013 CHEMBL3638700 NC1=N[C@@H](COc2ccc(Cl)c(Cl)c2)CO1 CHEMBL3684864 = 2.8 2013 CHEMBL3638700 CC1(c2ccc(F)cc2Cl)COC(N)=N1 CHEMBL3684886 = 2.0 2013 CHEMBL3638700 NC1=N[C@H](c2ccc(Br)cc2Cl)CO1 CHEMBL3684885 = 1.6 2013 CHEMBL3638700 NC1=N[C@@H](c2ccc(Br)cc2Cl)CO1 CHEMBL3684923 = 0.3 2013 CHEMBL3638700 Cc1ccc(Cl)cc1[C@H]1COC(N)=N1 CHEMBL3684884 = 3.0 2013 CHEMBL3638700 Cc1cc([C@@]2(C)COC(N)=N2)ccc1Cl CHEMBL3684863 = 1.9 2013 CHEMBL3638700 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2cccc(Cl)c2)[nH]n1 CHEMBL3663680 = 0.4 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2ccc(F)cc2)[nH]n1 CHEMBL3663681 = 2.7 2015 CHEMBL3638918 COc1cccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n[nH]2)c1 CHEMBL3663682 = 2.2 2015 CHEMBL3638918 Cn1nc(-c2ccccc2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663683 = 4.5 2015 CHEMBL3638918 Cc1c(-c2ccccc2)n[nH]c1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663684 = 8.0 2015 CHEMBL3638918 COc1ccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)[nH]n2)cc1 CHEMBL3663685 = 4.9 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2ccccc2F)n[nH]1 CHEMBL3663686 = 7.3 2015 CHEMBL3638918 COc1ccccc1-c1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)[nH]n1 CHEMBL3663687 = 14.0 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2ccccc2Cl)n[nH]1 CHEMBL3663688 = 2.6 2015 CHEMBL3638918 COc1ccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)[nH]n2)cc1OC CHEMBL3663689 = 12.7 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cc(-c2ccc(Cl)cc2)n[nH]1 CHEMBL3663690 = 0.4 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cc(-c2ccccc2Cl)n[nH]1 CHEMBL3663691 = 1.0 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2ccc(Cl)cc2)n[nH]1 CHEMBL3663692 = 2.8 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cc(-c2cccc(Cl)c2)n[nH]1 CHEMBL3663693 = 0.4 2015 CHEMBL3638918 COc1cccc(-c2cc(C(=O)Nc3ccc([C@@H]4CNCCO4)cc3)[nH]n2)c1 CHEMBL3663694 = 1.4 2015 CHEMBL3638918 Cn1nc(-c2cccc(Cl)c2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663695 = 2.4 2015 CHEMBL3638918 Cn1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1-c1ccccc1 CHEMBL3663696 = 25.4 2015 CHEMBL3638918 Cn1nc(-c2ccccc2)cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 CHEMBL3663697 = 2.8 2015 CHEMBL3638918 [C-]#[N+]c1cccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n[nH]2)c1 CHEMBL3663698 = 7.4 2015 CHEMBL3638918 [C-]#[N+]c1ccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n(C)n2)cc1 CHEMBL3663699 = 5.5 2015 CHEMBL3638918 Cn1nc(-c2ccc(F)cc2)cc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 CHEMBL3663700 = 2.2 2015 CHEMBL3638918 COc1cccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n(C)n2)c1 CHEMBL3663701 = 8.8 2015 CHEMBL3638918 Cn1nc(-c2cccc(C#N)c2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663702 = 14.2 2015 CHEMBL3638918 CCn1nc(-c2cccc(C#N)c2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663703 = 7.8 2015 CHEMBL3638918 [C-]#[N+]c1ccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n(CC)n2)cc1 CHEMBL3663704 = 31.6 2015 CHEMBL3638918 Cc1c(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)n[nH]c1-c1cccc(C#N)c1 CHEMBL3663705 = 13.5 2015 CHEMBL3638918 N#Cc1ccc(F)c(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n[nH]2)c1 CHEMBL3663706 = 12.9 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3663707 = 2.4 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccnn1-c1ccccc1 CHEMBL3663708 = 1321.2 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccn(-c2ccc(F)cc2)n1 CHEMBL3663709 = 2.4 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ccc(Cl)cn2)n1 CHEMBL3663710 = 1.1 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ccc(C(F)(F)F)cn2)n1 CHEMBL3663711 = 1.6 2015 CHEMBL3638918 N#Cc1ccc(-n2ccc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)cc1 CHEMBL3663712 = 9.2 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccn(-c2ccc(C(F)(F)F)cn2)n1 CHEMBL3663713 = 0.6 2015 CHEMBL3638918 N#Cc1cccc(-c2cc(C(=O)Nc3ccc([C@@H]4CCCNC4)cc3)[nH]n2)c1 CHEMBL3663714 = 13.8 2015 CHEMBL3638918 N#Cc1cccc(-c2cc(C(=O)Nc3ccc([C@H]4CCCNC4)cc3)[nH]n2)c1 CHEMBL3663715 = 2.7 2015 CHEMBL3638918 N#Cc1cccc(-c2cc(C(=O)Nc3ccc(C4CCNC4)cc3)[nH]n2)c1 CHEMBL3663716 = 4.2 2015 CHEMBL3638918 N#Cc1cc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)[nH]n2)ccc1F CHEMBL3663717 = 3.0 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(-c2cccc(OC(F)F)c2)n[nH]1 CHEMBL3663718 = 1.3 2015 CHEMBL3638918 CCn1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1-c1cccc(OC(F)F)c1 CHEMBL3663719 = 1.6 2015 CHEMBL3638918 CCn1nc(-c2cccc(OC(F)F)c2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663720 = 2.1 2015 CHEMBL3638918 N#Cc1cccc(-c2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)[nH]n2)c1F CHEMBL3663721 = 11.0 2015 CHEMBL3638918 Cn1nc(-c2cccc(OC(F)F)c2)cc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL3663722 = 26.2 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ccc(OC(F)F)cc2)n1 CHEMBL3663723 = 1.4 2015 CHEMBL3638918 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccn(-c2ccc(OC(F)F)cc2)n1 CHEMBL3663724 = 0.6 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ncc(C(F)(F)F)cn2)n1 CHEMBL3663725 = 19.6 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2cncc(Cl)n2)n1 CHEMBL3663726 = 11.8 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2nccnc2Cl)n1 CHEMBL3663727 = 139.0 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2cnc(Cl)cn2)n1 CHEMBL3663728 = 9.1 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2cc(C(F)(F)F)ncn2)n1 CHEMBL3663729 = 7.1 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2cncc(C(F)(F)F)n2)n1 CHEMBL3663730 = 7.4 2015 CHEMBL3638918 N#Cc1cnc(-n2ccc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)cn1 CHEMBL3663731 = 29.8 2015 CHEMBL3638918 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccn(-c2ccnc(C(F)(F)F)n2)n1 CHEMBL3663732 = 8.8 2015 CHEMBL3638918 c1ccc2[nH]c(-c3ccc(C4CNCCO4)cc3)nc2c1 CHEMBL3962606 = 760.0 2015 CHEMBL3886345 Clc1ccc2nc(-c3ccc(C4CNCCO4)cc3)[nH]c2c1 CHEMBL3985902 = 71.1 2015 CHEMBL3886345 Clc1ccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3957226 = 3.4 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3974552 = 5.9 2015 CHEMBL3886345 Clc1ccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)cn1 CHEMBL3948553 = 63.1 2015 CHEMBL3886345 N#Cc1ccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3946943 = 33.5 2015 CHEMBL3886345 Brc1cnc2nc(-c3ccc([C@H]4CNCCO4)cc3)[nH]c2c1 CHEMBL4111275 = 12.8 2015 CHEMBL3886345 Clc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3987102 = 2.0 2015 CHEMBL3886345 Clc1cccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)c1 CHEMBL3919526 = 2.1 2015 CHEMBL3886345 Fc1ccc2nc(-c3ccc([C@H]4CNCCO4)cc3)[nH]c2c1 CHEMBL4107332 = 1662.6 2015 CHEMBL3886345 Fc1cc(F)c2nc(-c3ccc([C@H]4CNCCO4)cc3)[nH]c2c1 CHEMBL4115310 = 59.7 2015 CHEMBL3886345 N#Cc1cccc(-c2cc(-c3ccc(C4CNCCO4)cc3)n[nH]2)c1 CHEMBL3906679 = 61.5 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)c(F)c1 CHEMBL4113214 = 30.5 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)c(F)c1 CHEMBL3924570 = 183.0 2015 CHEMBL3886345 Fc1ccc2nc(-c3ccc([C@@H]4CNCCO4)cc3)[nH]c2c1 CHEMBL3948960 = 284.6 2015 CHEMBL3886345 Cc1cc2nc(-c3ccc([C@H]4CNCCO4)cc3)[nH]c2cc1C CHEMBL4115166 = 1144.5 2015 CHEMBL3886345 Fc1ccc(-c2nnc(-c3ccc([C@H]4CNCCO4)cc3)o2)cc1 CHEMBL4115424 = 228.5 2015 CHEMBL3886345 Fc1ccc(-n2cc(-c3ccc([C@H]4CNCCO4)cc3)nn2)cc1 CHEMBL4113719 = 254.3 2015 CHEMBL3886345 Fc1ccc(-n2cc(-c3ccc([C@H]4CNCCO4)cc3)cn2)cc1 CHEMBL4110603 = 66.9 2015 CHEMBL3886345 Fc1ccc(-c2nc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL4110338 = 77.9 2015 CHEMBL3886345 O=C(Nc1n[nH]c2cc(C3CNCCO3)ccc12)c1ccc(F)cc1 CHEMBL3966198 = 895.0 2015 CHEMBL3886345 Fc1ccc([C@@H]2COC(c3ccc([C@H]4CNCCO4)cc3)=N2)cc1 CHEMBL3941840 = 1509.8 2015 CHEMBL3886345 Fc1ccc(-c2nc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3936382 = 19.6 2015 CHEMBL3886345 c1cc([C@H]2CNCCO2)ccc1-c1cc(C2CCOCC2)[nH]n1 CHEMBL4108055 = 72.2 2015 CHEMBL3886345 Fc1ccc(-c2ncn(-c3ccc([C@H]4CNCCO4)cc3)n2)cc1 CHEMBL4106961 = 140.2 2015 CHEMBL3886345 Fc1ccc(-n2cc(-c3ccc([C@@H]4CNCCO4)cc3)cn2)cc1 CHEMBL3954579 = 12.2 2015 CHEMBL3886345 Fc1ccc(-c2cn(-c3ccc([C@H]4CNCCO4)cc3)nn2)cc1 CHEMBL4115009 = 56.5 2015 CHEMBL3886345 N#Cc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL4111316 = 16.8 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL4111478 = 4.4 2015 CHEMBL3886345 O=C(Nc1cc(-c2ccc([C@H]3CNCCO3)cc2)n[nH]1)c1ccc(F)cc1 CHEMBL4114957 = 373.6 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3932375 = 3.6 2015 CHEMBL3886345 N#Cc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)cc1 CHEMBL3908972 = 15.4 2015 CHEMBL3886345 N#Cc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)c(F)c1 CHEMBL4109790 = 20.1 2015 CHEMBL3886345 Fc1ccc(-c2nnc(-c3ccc([C@@H]4CNCCO4)cc3)o2)cc1 CHEMBL3915597 = 156.0 2015 CHEMBL3886345 Fc1ccc(-n2cc(-c3ccc([C@@H]4CNCCO4)cc3)nn2)cc1 CHEMBL3893414 = 25.2 2015 CHEMBL3886345 Fc1ccc(-c2ncn(-c3ccc([C@@H]4CNCCO4)cc3)n2)cc1 CHEMBL3925172 = 85.7 2015 CHEMBL3886345 Clc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)cn1 CHEMBL4112189 = 303.6 2015 CHEMBL3886345 Clc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3)n[nH]2)cn1 CHEMBL3919715 = 25.7 2015 CHEMBL3886345 Fc1ccc(-c2cn(-c3ccc([C@@H]4CNCCO4)cc3)nn2)cc1 CHEMBL3926945 = 32.2 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3F)n[nH]2)cc1 CHEMBL4107157 = 15.5 2015 CHEMBL3886345 Fc1ccc(-c2cc(-c3ccc([C@@H]4CNCCO4)cc3F)n[nH]2)cc1 CHEMBL3901642 = 4.3 2015 CHEMBL3886345 Clc1cc(-c2cc(-c3ccc([C@H]4CNCCO4)cc3)n[nH]2)ccn1 CHEMBL4115282 = 17.1 2015 CHEMBL3886345 Fc1ccc(-c2nc3cc([C@H]4CNCCO4)ccc3[nH]2)cc1 CHEMBL4115473 = 29.1 2015 CHEMBL3886345 Fc1ccc(-c2nc3cc([C@@H]4CNCCO4)ccc3[nH]2)cc1 CHEMBL3891574 = 57.1 2015 CHEMBL3886345 c1cnc2[nH]c3ccc([C@H]4CNCCO4)cc3c2c1 CHEMBL4112046 = 1002.1 2015 CHEMBL3886345 FC(F)(F)c1cnc2[nH]c3ccc([C@H]4CNCCO4)cc3c2c1 CHEMBL4114904 = 69.8 2015 CHEMBL3886345 Clc1cnc2[nH]c3ccc([C@H]4CNCCO4)cc3c2c1 CHEMBL4109129 = 75.0 2015 CHEMBL3886345 FC(F)(F)c1cnc2[nH]c3ccc([C@@H]4CNCCO4)cc3c2c1 CHEMBL3896386 = 63.9 2015 CHEMBL3886345 FC(F)(F)c1ccc2c(n1)[nH]c1ccc([C@H]3CNCCO3)cc12 CHEMBL4110739 = 18.2 2015 CHEMBL3886345 FC(F)(F)c1cnc2[nH]c3ccc([C@@H]4CNCCO4)cc3c2c1 CHEMBL3896386 = 30.3 2015 CHEMBL3886345 CC(C)Oc1ncc2c(n1)[nH]c1ccc([C@H]3CNCCO3)cc12 CHEMBL4112266 = 90.4 2015 CHEMBL3886345 CCOc1ccc(-c2nc3ccc([C@@H]4CNCCO4)cc3o2)cn1 CHEMBL3972129 = 87.3 2015 CHEMBL3886345 FC(F)(F)c1ccc(-c2nc3ccc([C@@H]4CNCCO4)cc3o2)cn1 CHEMBL3942530 = 226.1 2015 CHEMBL3886345 FC(F)(F)c1cc(-c2nc3ccc([C@@H]4CNCCO4)cc3o2)ccn1 CHEMBL3935911 = 447.9 2015 CHEMBL3886345 FC(F)(F)c1cc(-c2nc3ccc([C@H]4CNCCO4)cc3o2)ccn1 CHEMBL4110828 = 303.6 2015 CHEMBL3886345 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccccc2)n1 CHEMBL4112575 = 1.3 2016 CHEMBL3886861 Cc1nn(-c2ccccc2)nc1C(=O)Nc1ccc([C@H]2CNCCO2)cc1 CHEMBL4112126 = 0.8 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(OC(F)F)cc2)n1 CHEMBL4110196 = 26.8 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(F)cc2)n1 CHEMBL4107378 = 34.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2cccc(F)c2)n1 CHEMBL4113358 = 21.1 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(Cl)cc2)n1 CHEMBL4107293 = 0.2 2016 CHEMBL3886861 Cc1nn(-c2ccccc2)nc1C(=O)Nc1ccc([C@@H]2CNCCO2)cc1 CHEMBL3919809 = 0.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cnn(-c2ccccc2)n1 CHEMBL3892304 = 0.8 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(F)cc2)n1 CHEMBL4107378 = 0.6 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(C(F)(F)F)cc2)n1 CHEMBL4114308 = 0.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2cccc(F)c2)n1 CHEMBL4113358 = 0.4 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2cccc(Cl)c2)n1 CHEMBL4107987 = 0.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2cccc(C(F)(F)F)c2)n1 CHEMBL4111318 = 0.6 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(OC(F)(F)F)cc2)n1 CHEMBL4109271 = 3.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(OC(F)(F)F)cc2)n1 CHEMBL4109271 = 0.1 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2ccc(OC(F)F)cc2)n1 CHEMBL4110196 = 0.2 2016 CHEMBL3886861 Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)cc1 CHEMBL4115201 = 17.4 2016 CHEMBL3886861 Cc1ccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)cc1 CHEMBL4115577 = 1.6 2016 CHEMBL3886861 COc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)cc1 CHEMBL4111749 = 38.8 2016 CHEMBL3886861 COc1ccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)cc1 CHEMBL4113967 = 1.9 2016 CHEMBL3886861 CCOc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)cc1 CHEMBL4108132 = 29.3 2016 CHEMBL3886861 CCOc1ccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)cc1 CHEMBL4109091 = 1.0 2016 CHEMBL3886861 Cc1cccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)c1 CHEMBL4113988 = 0.5 2016 CHEMBL3886861 Cc1cccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)c1 CHEMBL4115571 = 6.9 2016 CHEMBL3886861 COc1cccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)c1 CHEMBL4114839 = 9.2 2016 CHEMBL3886861 CCOc1cccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)nn2)c1 CHEMBL4111945 = 3.2 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cn(-c2cccc(OC(F)(F)F)c2)nn1 CHEMBL4113609 = 15.4 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cnn(-c2cccc(OC(F)(F)F)c2)n1 CHEMBL4106987 = 15.6 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cn(-c2cccc(OC(F)F)c2)nn1 CHEMBL4111266 = 0.6 2016 CHEMBL3886861 COc1cccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)c1 CHEMBL4112742 = 8.2 2016 CHEMBL3886861 CCOc1cccc(-n2ncc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3)n2)c1 CHEMBL4113799 = 106.6 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ncn(-c2ccc(OC(F)F)cc2)n1 CHEMBL4106968 = 45.0 2016 CHEMBL3886861 O=C(Nc1ccc(C2CCNC2)cc1)c1cn(-c2ccc(OC(F)F)cc2)nn1 CHEMBL3929285 = 18.9 2016 CHEMBL3886861 O=C(Nc1ccc(C2CCNC2)cc1)c1cnn(-c2ccccc2)n1 CHEMBL3960309 = 1.0 2016 CHEMBL3886861 O=C(Nc1ccc(C2CCCNC2)cc1)c1cnn(-c2ccccc2)n1 CHEMBL3936416 = 1.7 2016 CHEMBL3886861 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cn(-c2ccc(Br)cn2)nn1 CHEMBL4113409 = 30.0 2016 CHEMBL3886861 CCCCc1ccc(NC(=O)Nc2ccc(C3CCNC3)cc2)c(C)c1 CHEMBL3895949 = 7.2 2016 CHEMBL3886960 CN1CCN(c2ccc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2)CC1 CHEMBL3918526 = 1.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1ccc(Cl)c(Cl)c1 CHEMBL3890475 = 1.6 2016 CHEMBL3886960 CN1CCN(c2ccc(NC(=O)Nc3ccc(-c4cnco4)cc3)cc2)CC1 CHEMBL3971608 = 83.7 2016 CHEMBL3886960 O=C(Nc1ccc(Cl)cc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3945460 = 2.7 2016 CHEMBL3886960 O=C(Nc1ccccc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3932905 = 29.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1ccc(Cl)cc1Cl CHEMBL3904911 = 3.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1cccc(Cl)c1 CHEMBL3893973 = 4.4 2016 CHEMBL3886960 O=C(NCc1ccccc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3959457 = 1112.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)NC1CCCCC1 CHEMBL3955268 = 309.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Oc1ccccc1 CHEMBL3927652 = 31.5 2016 CHEMBL3886960 O=C(Cc1ccccc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3949998 = 289.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3900886 = 99.5 2016 CHEMBL3886960 CN(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3907384 = 644.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Oc1ccc(F)cc1 CHEMBL3913229 = 8.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3949981 = 4.3 2016 CHEMBL3886960 O=C(Cc1ccc(Cl)cc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3918725 = 36.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(C(F)(F)F)cc1 CHEMBL3947724 = 3.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1Cl CHEMBL3919936 = 18.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1cccc(Cl)c1 CHEMBL3908541 = 7.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)N1CCOCC1 CHEMBL3932953 = 359.1 2016 CHEMBL3886960 CN(C(=O)Oc1ccccc1)c1ccc(C2CCNC2)cc1 CHEMBL3945588 = 2369.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Oc1ccc(Cl)cc1 CHEMBL3923677 = 2.5 2016 CHEMBL3886960 O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(C2CCNC2)cc1 CHEMBL3984807 = 49.7 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3918569 = 75.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1ccc(Cl)nc1 CHEMBL3939738 = 27.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1ccc(C(F)(F)F)cc1 CHEMBL3909652 = 1.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)N1CCCCC1 CHEMBL3971752 = 473.3 2016 CHEMBL3886960 C[C@@H](C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL4114941 = 50.1 2016 CHEMBL3886960 C[C@H](C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3935141 = 72.2 2016 CHEMBL3886960 O=C(CCc1ccccc1Cl)Nc1ccc(C2CCNC2)cc1 CHEMBL3912277 = 61.3 2016 CHEMBL3886960 CN1CCC(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)C1 CHEMBL3927727 = 85.8 2016 CHEMBL3886960 CCN1CCC(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)C1 CHEMBL3899715 = 54.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCN(Cc3ccccc3)C2)cc1)c1ccc(Cl)cc1 CHEMBL3899407 = 213.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCN(CCc3ccccc3)C2)cc1)c1ccc(Cl)cc1 CHEMBL3890735 = 78.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCN(c3ccccc3)C2)cc1)c1ccc(Cl)cc1 CHEMBL3913317 = 323.9 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3983166 = 11.4 2016 CHEMBL3886960 CCC(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3926846 = 60.6 2016 CHEMBL3886960 O=C(Nc1ccc(OC2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3920026 = 13.9 2016 CHEMBL3886960 CC1(c2ccc(NC(=O)Nc3cccc(Cl)c3)cc2)CCN(Cc2ccccc2)C1 CHEMBL3974740 = 521.8 2016 CHEMBL3886960 CC1(c2ccc(NC(=O)c3ccccc3)cc2)CCNC1 CHEMBL3903844 = 2980.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cn1 CHEMBL3979600 = 35.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)nc1 CHEMBL3914222 = 24.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1ccc(Cl)cn1 CHEMBL3890259 = 2.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OC1CCC(F)(F)CC1 CHEMBL3918292 = 7.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1ccc(F)cc1 CHEMBL3902799 = 1.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCc1ccc(F)cc1 CHEMBL3927237 = 4.8 2016 CHEMBL3886960 CO[C@H](C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL3911817 = 613.2 2016 CHEMBL3886960 CO[C@@H](C(=O)Nc1ccc(C2CCNC2)cc1)c1ccccc1 CHEMBL4109351 = 1684.8 2016 CHEMBL3886960 COC(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccc(Br)cc1 CHEMBL3901175 = 121.7 2016 CHEMBL3886960 COCc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3972313 = 98.5 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3910248 = 10.9 2016 CHEMBL3886960 CCCc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3977269 = 5.3 2016 CHEMBL3886960 C#Cc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3915604 = 15.2 2016 CHEMBL3886960 N#Cc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3985354 = 74.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL3896435 = 1.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNCC2)cc1)c1ccc(Cl)cc1 CHEMBL3971113 = 0.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3908995 = 2.2 2016 CHEMBL3886960 O=C(Nc1ccc(N2CCNCC2)cc1)c1ccc(Cl)cc1 CHEMBL3979296 = 1.4 2016 CHEMBL3886960 COC(C(=O)Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3909545 = 45.7 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1cccc(C(F)(F)F)c1 CHEMBL3941012 = 3.3 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1cccc(OC(F)(F)F)c1 CHEMBL3904003 = 4.6 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNC[C@H]2O)cc1)c1ccc(Cl)cc1 CHEMBL3932004 = 174.3 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1cccc(C(=O)c2ccccc2)c1 CHEMBL3902832 = 21.5 2016 CHEMBL3886960 COc1cccc(CC(=O)Nc2ccc(C3CCNC3)cc2)c1 CHEMBL3927271 = 352.3 2016 CHEMBL3886960 N#Cc1cccc(CC(=O)Nc2ccc(C3CCNC3)cc2)c1 CHEMBL3918479 = 644.7 2016 CHEMBL3886960 COc1cccc(C(C)C(=O)Nc2ccc(C3CCNC3)cc2)c1 CHEMBL3946346 = 55.5 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCNC2)cc1)c1cccc(C#N)c1 CHEMBL3917247 = 102.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNC[C@@H]2F)cc1)c1ccc(Cl)cc1 CHEMBL3948576 = 23.0 2016 CHEMBL3886960 O=C(Nc1ccc(OC2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3920026 = 93.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Cl)cc1 CHEMBL3903106 = 12.1 2016 CHEMBL3886960 O=C(Nc1cccc(C2CNCCO2)c1)c1ccc(Cl)cc1 CHEMBL3975656 = 107.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(-n2cccn2)nc1 CHEMBL3900637 = 25.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)nc1 CHEMBL3948891 = 67.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ncc(F)cc1F CHEMBL3924590 = 1476.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1nc2ccccc2[nH]1 CHEMBL3940117 = 295.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1F CHEMBL3912121 = 23.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)cn1 CHEMBL3926868 = 46.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)Nc1ccc(Cl)nc1 CHEMBL3895372 = 92.4 2016 CHEMBL3886960 CN1CCOC(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)C1 CHEMBL3971817 = 741.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)Nc1cccc2cccnc12 CHEMBL3956210 = 12.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ncccc1F CHEMBL3889958 = 1768.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)Nc1ccc(Cl)cn1 CHEMBL3979780 = 12.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc2ccccc2n1 CHEMBL3955400 = 38.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1nccc2ccccc12 CHEMBL3984037 = 20.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1cc(Cl)ccn1 CHEMBL3960690 = 115.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(Br)cn1 CHEMBL3895239 = 17.0 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)c(F)c1 CHEMBL3932801 = 101.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3905624 = 6.0 2016 CHEMBL3886960 COc1cc(C(=O)Nc2ccc(C3CCNC3)cc2)nc2ccccc12 CHEMBL3915210 = 10.1 2016 CHEMBL3886960 COc1ccc2nc(C(=O)Nc3ccc(C4CCNC4)cc3)ccc2c1 CHEMBL3974948 = 22.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1cccc(Cl)c1 CHEMBL3964317 = 23.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1nccc2ccsc12 CHEMBL3924695 = 172.9 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)nc1 CHEMBL3900792 = 378.7 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)c(OC)n1 CHEMBL3984826 = 321.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL3909852 = 6.7 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(C3CCCNC3)cc2)cc1 CHEMBL3976930 = 19.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(C(F)(F)F)cc1 CHEMBL3979942 = 11.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)cc1Cl CHEMBL3950991 = 50.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)cc1F CHEMBL3918412 = 30.8 2016 CHEMBL3886960 O=C(CCc1ccc(Cl)cc1)Nc1ccc(C2CCCNC2)cc1 CHEMBL3963353 = 26.3 2016 CHEMBL3886960 O=C(Cc1ccc(Cl)cc1)Nc1ccc(C2CCCNC2)cc1 CHEMBL3976460 = 89.4 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3905721 = 64.6 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCCNC2)cc1)c1cccc(C(F)(F)F)c1 CHEMBL3967938 = 27.6 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCCNC2)cc1)c1cccc(OC(F)(F)F)c1 CHEMBL3900340 = 13.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ncc(F)cc1F CHEMBL3960362 = 1427.3 2016 CHEMBL3886960 O=C(Nc1ccc(CC2CCCN2)cc1)c1ccc(Cl)cc1 CHEMBL3891310 = 44.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1cc2ccccc2c(Cl)n1 CHEMBL3953959 = 8.1 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3979497 = 17.6 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3941142 = 37.5 2016 CHEMBL3886960 CC(C(=O)Nc1ccc(C2CCCNC2)cc1)c1cccc(Cl)c1 CHEMBL3926095 = 38.2 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(Cl)cc1 CHEMBL4113290 = 1.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3928610 = 4.0 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCNC2)cc1)Nc1ccc(Cl)cn1 CHEMBL3919696 = 7.4 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)Nc1ccc(Cl)cn1 CHEMBL3950913 = 11.8 2016 CHEMBL3886960 O=C(Nc1ccc(Cl)cc1)Nc1ccc(CCC2CCNC2)cc1 CHEMBL3914186 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCNC2)cc1)c1ccc(Cl)cn1 CHEMBL3942181 = 2.9 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)c1ccc(Cl)cn1 CHEMBL3948722 = 8.1 2016 CHEMBL3886960 O=C(Nc1ccc(Cl)cc1)Nc1ccc(CCC2CCCNC2)cc1 CHEMBL3974698 = 1.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1ccc(Cl)cc1 CHEMBL3941684 = 1.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1cccc(Cl)c1 CHEMBL3913699 = 0.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1ccc(C(F)(F)F)cc1 CHEMBL3950408 = 1.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1cccc(C(F)(F)F)c1 CHEMBL3926222 = 2.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1cc(F)ccc1F CHEMBL3927247 = 3.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1ccc(OC(F)(F)F)cc1 CHEMBL3899215 = 0.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCc1ccc(Cl)c(Cl)c1 CHEMBL3936207 = 2.2 2016 CHEMBL3886960 CC(OC(=O)Nc1ccc(C2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3904711 = 2.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OCCCc1ccc(Cl)cc1 CHEMBL3949293 = 0.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OC1Cc2ccccc2C1 CHEMBL3921496 = 6.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)OC(c1ccc(Cl)cc1)C(F)(F)F CHEMBL3968369 = 16.9 2016 CHEMBL3886960 CC(CC(F)(F)F)OC(=O)Nc1ccc(C2CCNC2)cc1 CHEMBL3897246 = 21.9 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCNC2)cc1)c1ncccc1F CHEMBL3973702 = 140.6 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCNC2)cc1)c1ncc(F)cc1F CHEMBL3907834 = 17.4 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)c1ncccc1F CHEMBL3952856 = 105.7 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)c1ncccc1F CHEMBL3952856 = 105.7 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCNC2)cc1)c1ncc(F)cc1F CHEMBL3981605 = 13.4 2016 CHEMBL3886960 O=C(Nc1ccc(C(=O)C2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3967293 = 0.8 2016 CHEMBL3886960 CCCc1ccc(C(=O)Nc2ccc(C3CCCNC3)cc2)cc1 CHEMBL3926524 = 1.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(C(F)(F)F)cn1 CHEMBL3918143 = 5.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1ccc(C(F)(F)F)cn1 CHEMBL3958431 = 5.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)nc1)c1ccc(Cl)cc1 CHEMBL3912684 = 35.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(C(F)(F)F)cn1 CHEMBL3971133 = 2.4 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1ccc(Cl)cc1 CHEMBL3903667 = 0.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccc(Cl)cc1 CHEMBL3898173 = 0.6 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)cc1 CHEMBL4106449 = 1.1 2016 CHEMBL3886960 O=C(Nc1ccc(COC2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3894865 = 1.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Cl)cc1F CHEMBL3934374 = 1.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Cl)cn1 CHEMBL3904872 = 4.9 2016 CHEMBL3886960 O=C(Nc1ccc(CC2CCNC2)cc1)c1ccc(Cl)cc1 CHEMBL3978844 = 1.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL3946885 = 0.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1cccc(Cl)c1 CHEMBL3976172 = 0.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL4110000 = 0.3 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cccc(Cl)c1 CHEMBL4107058 = 0.5 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL3975226 = 0.2 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1ccc(C(F)(F)F)cc1 CHEMBL3900861 = 0.9 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1ccc(F)cc1 CHEMBL3960884 = 2.0 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1cccc(Cl)c1 CHEMBL3891881 = 0.7 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(CCC3CCCN3)cc2)cc1 CHEMBL3936150 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCCN2)cc1)c1ccc(Cl)cc1 CHEMBL3977321 = 629.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1cnc(Cl)cn1 CHEMBL3982641 = 4.6 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(Cl)nc1 CHEMBL3893736 = 10.1 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(Cl)nc1 CHEMBL4114605 = 9.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCNC2)cc1)c1cnc(Cl)cn1 CHEMBL3959211 = 12.1 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1cnc(Cl)cn1 CHEMBL3947477 = 12.1 2016 CHEMBL3886960 N#Cc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)nc1 CHEMBL3946449 = 41.1 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCN2)cc1)c1ccc(F)cn1 CHEMBL3908144 = 21.2 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(Cl)cn1 CHEMBL3975733 = 4.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(Cl)cn1 CHEMBL4111941 = 2.6 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(Cl)cc1 CHEMBL3939209 = 2.7 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(F)cc1 CHEMBL3979014 = 15.8 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(Cl)cn1 CHEMBL3908667 = 10.1 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(CCC3CCCN3)cc2)nc1 CHEMBL3893119 = 7.7 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(Cl)nc1 CHEMBL3960135 = 21.8 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1cnc(Cl)cn1 CHEMBL3965641 = 15.9 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(C(F)(F)F)cc1 CHEMBL3917814 = 2.7 2016 CHEMBL3886960 O=C(Nc1ccc(CCC2CCCCN2)cc1)c1ccc(Cl)c(Cl)c1 CHEMBL3970767 = 1.0 2016 CHEMBL3886960 C#Cc1ccc(C(=O)Nc2ccc(CCC3CCCCN3)cc2)cc1 CHEMBL3903151 = 6.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3971995 = 2.0 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(C3CCCNC3)cc2)nc1 CHEMBL3900847 = 2.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(F)cn1 CHEMBL3919554 = 13.1 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc(C3CCNC3)cc2)cc1 CHEMBL3910611 = 2.5 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc(C3CCCNC3)cc2)cc1 CHEMBL3909541 = 2.6 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc(C3CCCNC3)cc2)cc1 CHEMBL3925002 = 2.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cn1)c1ccc(Cl)cc1 CHEMBL3896949 = 12.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccccc1 CHEMBL3927266 = 5.5 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3923910 = 1.6 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3958841 = 2.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CCCNC2)cc1)c1ccc(OCC(F)(F)F)cn1 CHEMBL3984063 = 7.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(OCc2ccccc2)cc1 CHEMBL3946727 = 11.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Cl)nc1 CHEMBL3976040 = 3.4 2016 CHEMBL3886960 N#Cc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cn1 CHEMBL3909842 = 5.0 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 CHEMBL3904270 = 2.2 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 CHEMBL4107790 = 1.0 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3932272 = 1.6 2016 CHEMBL3886960 CCc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3895354 = 2.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(O)cc1 CHEMBL3919850 = 238.1 2016 CHEMBL3886960 COc1cc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)ccc1Cl CHEMBL3953805 = 2.2 2016 CHEMBL3886960 COc1cc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)ccc1Cl CHEMBL4114383 = 2.2 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cc1Cl CHEMBL3893555 = 1.5 2016 CHEMBL3886960 COc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc1Cl CHEMBL4111618 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3911624 = 4.3 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL4111116 = 3.5 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Oc2ccc(Cl)cc2)cc1 CHEMBL3977707 = 1.1 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccc(Cl)nc1 CHEMBL3917053 = 4.2 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)nc1 CHEMBL4109904 = 4.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1cccc(Cl)c1 CHEMBL3893342 = 1.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1cncc(Cl)c1 CHEMBL3944214 = 6.2 2016 CHEMBL3886960 COC(=O)c1ccc(COc2ccc(C(=O)Nc3ccc(C4CNCCO4)cc3)cc2)cc1 CHEMBL3919815 = 0.9 2016 CHEMBL3886960 O=C(O)c1ccc(COc2ccc(C(=O)Nc3ccc(C4CNCCO4)cc3)cc2)cc1 CHEMBL3935238 = 295.8 2016 CHEMBL3886960 COC(=O)c1ccc(Oc2ccc(C(=O)Nc3ccc(C4CNCCO4)cc3)cc2)cc1Cl CHEMBL3907300 = 1.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(OCC2CC2)cc1 CHEMBL3929794 = 1.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(Oc2ccc(C(=O)O)c(Cl)c2)cc1 CHEMBL3916247 = 2310.1 2016 CHEMBL3886960 CSc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3948822 = 1.2 2016 CHEMBL3886960 Cc1nc(C(=O)Nc2ccc(C3CNCCO3)cc2)cs1 CHEMBL3921016 = 94.1 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccnc(Cl)c1 CHEMBL3936493 = 8.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1cnc(Cl)c(Cl)c1 CHEMBL3912071 = 3.1 2016 CHEMBL3886960 CC(CO)(CCl)COc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3986472 = 2.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1cc(Cl)nc(Cl)c1 CHEMBL3917358 = 3.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3894818 = 3.3 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3919403 = 1.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL4109827 = 2.9 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc1Cl CHEMBL4106666 = 0.6 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)ccc1Cl CHEMBL4115183 = 1.0 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc1C CHEMBL4111919 = 1.2 2016 CHEMBL3886960 CC1(COc2ccc(C(=O)Nc3ccc(C4CNCCO4)cc3)cc2)COC1 CHEMBL3950745 = 60.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccc(Cl)cc1F CHEMBL3910872 = 1.9 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)cc1F CHEMBL4108638 = 1.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1cnc(-c2ccccc2)s1 CHEMBL3946932 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(OC2CCOCC2)nc1 CHEMBL3919814 = 31.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2ccccc2)n1 CHEMBL3895320 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cccc(C(F)(F)F)c1 CHEMBL4107015 = 1.0 2016 CHEMBL3886960 O=C(COc1ccc(Cl)cc1)Nc1ccc([C@@H]2CCCNC2)cc1 CHEMBL4108493 = 0.6 2016 CHEMBL3886960 CSc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc1 CHEMBL4109016 = 1.4 2016 CHEMBL3886960 CCSc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc1 CHEMBL4110686 = 0.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cnc(Cl)cn1 CHEMBL4115131 = 5.6 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1cnc(Cl)cn1 CHEMBL3890543 = 8.5 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)OCc1ccc(Cl)cc1 CHEMBL4113550 = 0.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(N2CCOCC2)nc1 CHEMBL3979686 = 116.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL4109171 = 8.9 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4113289 = 6.2 2016 CHEMBL3886960 CSc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4111647 = 4.9 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cn1 CHEMBL3972763 = 6.3 2016 CHEMBL3886960 CCSc1cccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)c1 CHEMBL4108809 = 1.2 2016 CHEMBL3886960 Cc1cnc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4107612 = 67.7 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cnc(C(F)(F)F)cn1 CHEMBL4111369 = 14.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1coc(-c2ccccc2)n1 CHEMBL3895886 = 2.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cnc(OCC(F)(F)F)cn1 CHEMBL4111574 = 5.6 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cnc(Br)cn1 CHEMBL4107586 = 5.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1ccc(Br)nc1 CHEMBL4111014 = 4.4 2016 CHEMBL3886960 Cc1cccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)c1 CHEMBL4107178 = 3.5 2016 CHEMBL3886960 CO[C@H]1CC[C@@H](C(=O)Nc2ccc(C3CNCCO3)cc2)CC1 CHEMBL3967255 = 725.5 2016 CHEMBL3886960 CO[C@H]1CC[C@H](C(=O)Nc2ccc(C3CNCCO3)cc2)CC1 CHEMBL3941089 = 427.8 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4111209 = 12.0 2016 CHEMBL3886960 CSc1cnc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4112595 = 4.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)OC1Cc2ccccc2C1 CHEMBL4112255 = 6.2 2016 CHEMBL3886960 CSc1cccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)c1 CHEMBL4109038 = 0.9 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cc1C CHEMBL3912641 = 1.2 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1cccc(C(F)(F)F)c1 CHEMBL3896360 = 1.5 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cccc(Cl)c1 CHEMBL3953740 = 1.3 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cccc(Cl)c1 CHEMBL4110462 = 1.1 2016 CHEMBL3886960 Cc1ccc(C(=O)Nc2ccc([C@H]3CCCNC3)cc2)cn1 CHEMBL3927124 = 14.3 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CCCNC2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL3948537 = 5.9 2016 CHEMBL3886960 CSc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 CHEMBL3932593 = 1.2 2016 CHEMBL3886960 CSc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 CHEMBL4110717 = 1.1 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3959893 = 2.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL4107759 = 3.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1cc(Cl)nc(Cl)c1 CHEMBL3919915 = 4.5 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1cc(Cl)nc(Cl)c1 CHEMBL4110584 = 4.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL3956381 = 16.9 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc(Cl)n1 CHEMBL3925365 = 8.0 2016 CHEMBL3886960 CCc1cnc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4108913 = 17.4 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc1 CHEMBL3934263 = 3.6 2016 CHEMBL3886960 CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc1 CHEMBL4108458 = 0.8 2016 CHEMBL3886960 Cc1cccc(C(=O)Nc2ccc(C3CNCCO3)cc2)c1 CHEMBL3946662 = 3.6 2016 CHEMBL3886960 CCCc1cnc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4114590 = 11.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccc(N2CCCC2)nc1 CHEMBL3912151 = 4.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccnc(C(F)(F)F)c1 CHEMBL3917049 = 6.9 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CCCNC2)cc1)c1cc(Cl)nc(Cl)c1 CHEMBL4107732 = 1.4 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cc(Cl)n1 CHEMBL4110636 = 4.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL3897343 = 5.9 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL4107878 = 5.0 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc([C@@H]3CNCCO3)cc2)cc(Cl)n1 CHEMBL3913528 = 5.0 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cc(Cl)n1 CHEMBL4110737 = 4.4 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)C1CCN(c2ccncn2)CC1 CHEMBL3953678 = 378.9 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2cnccn2)n1 CHEMBL3909321 = 7.5 2016 CHEMBL3886960 CCCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4113527 = 2.7 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1csc(-c2ncccn2)n1 CHEMBL3919845 = 323.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)Nc1ccc(C(F)(F)F)cc1 CHEMBL3895348 = 1.7 2016 CHEMBL3886960 O=C(Nc1ccc(Cl)cc1)Nc1ccc(C2CNCCO2)cc1 CHEMBL3938990 = 1.0 2016 CHEMBL3886960 Cc1ccc(NC(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3911027 = 1.4 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1 CHEMBL3933475 = 22.6 2016 CHEMBL3886960 Cc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1 CHEMBL3933475 = 1196.8 2016 CHEMBL3886960 Cn1cc(-c2nc(C(=O)Nc3ccc(C4CNCCO4)cc3)cs2)cn1 CHEMBL3903043 = 84.7 2016 CHEMBL3886960 CCc1ccc(C(=O)Nc2ccc([C@@H]3CCCNC3)cc2)cn1 CHEMBL4110453 = 4.4 2016 CHEMBL3886960 Cc1nc(-c2cnccn2)sc1C(=O)Nc1ccc(C2CNCCO2)cc1 CHEMBL3955311 = 14.3 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)c1ccn(-c2ccccc2)n1 CHEMBL3931194 = 1.4 2016 CHEMBL3886960 CCOc1cc(C(=O)Nc2ccc(C3CNCCO3)cc2)ccn1 CHEMBL3974109 = 2.0 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)cc1I CHEMBL4109911 = 7.0 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)Nc1ccc(Cl)nc1 CHEMBL3892560 = 5.6 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)Nc1cccc(Cl)c1 CHEMBL3924064 = 0.5 2016 CHEMBL3886960 Cc1cccc(NC(=O)Nc2ccc(C3CNCCO3)cc2)c1 CHEMBL3901508 = 1.2 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)Nc1ccccc1Cl CHEMBL3929452 = 3.8 2016 CHEMBL3886960 Cc1ccc(CNC(=O)Nc2ccc(C3CNCCO3)cc2)cc1 CHEMBL3983704 = 3.8 2016 CHEMBL3886960 O=C(Nc1ccc(C2CNCCO2)cc1)NC1CCCCC1 CHEMBL3910438 = 30.5 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCCO2)cc1)c1cccc(Cl)c1 CHEMBL4107107 = 1.8 2016 CHEMBL3886960 C[C@H]1CNC[C@H](c2ccc(NC(=O)c3cccc(Cl)c3)cc2)O1 CHEMBL3922853 = 2.3 2016 CHEMBL3886960 C[C@@H]1CNC[C@H](c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)O1 CHEMBL4115499 = 10.8 2016 CHEMBL3886960 O=C(Nc1ccc([C@@H]2CNCCO2)cc1)Nc1ccc(C(F)(F)F)cc1 CHEMBL3925291 = 1.4 2016 CHEMBL3886960 O=C(Nc1ccc([C@H]2CNCCO2)cc1)Nc1ccc(C(F)(F)F)cc1 CHEMBL4111767 = 1.1 2016 CHEMBL3886960 O=C(NCc1ccc([C@@H]2CNCCO2)cc1)c1cccc(Cl)c1 CHEMBL3902074 = 15.4 2016 CHEMBL3886960 O=C(NCc1ccc([C@@H]2CNCCO2)cc1)c1ccc(Cl)cc1 CHEMBL3890670 = 6.2 2016 CHEMBL3886960 O=C(NCc1ccc([C@@H]2CNCCO2)cc1)c1ccc(Cl)nc1 CHEMBL3903186 = 9.0 2016 CHEMBL3886960 O=C(NCc1ccc([C@@H]2CNCCO2)cc1)c1ccc(OCC(F)(F)F)nc1 CHEMBL3965665 = 12.1 2016 CHEMBL3886960 O=C(NCc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)cc1 CHEMBL4115056 = 22.6 2016 CHEMBL3886960 O=C(NCc1ccc([C@H]2CNCCO2)cc1)c1cccc(Cl)c1 CHEMBL4108109 = 31.2 2016 CHEMBL3886960 O=C(NCc1ccc([C@H]2CNCCO2)cc1)c1ccc(Cl)nc1 CHEMBL4110706 = 20.6 2016 CHEMBL3886960 O=C(NCc1ccc([C@H]2CNCCO2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL4111824 = 24.9 2016 CHEMBL3886960 O=C(NCc1ccc([C@@H]2CNCCO2)cc1)c1ccc(C(F)(F)F)nc1 CHEMBL3932914 = 26.0 2016 CHEMBL3886960 C[C@H]1CO[C@@H](c2ccc(NC(=O)c3cccc(Cl)c3)cc2)CN1 CHEMBL3977618 = 1.7 2016 CHEMBL3886960 C[C@@H]1CO[C@@H](c2ccc(NC(=O)c3cccc(Cl)c3)cc2)CN1 CHEMBL4106769 = 1.3 2016 CHEMBL3886960