0 B21R3.212 Brc1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000185839 [1,0,0,0,0,0|1,1,1]=4 1 B21R3.212 Cc1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000188618 [1,0,0,0,0,0|2,0,1]=4 2 B21R3.212 Clc1ccc(cc1)c2noc(n2)Cc3cccnc3 270196a_100000184291_100000737805 [1,0,0,0,0,0|2,0,1]=4 3 B21R3.212 Fc1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000187176 [1,0,0,0,0,0|1,1,1]=4 4 B21R3.212 Ic1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000187904 [1,0,0,0,0,0|1,1,1]=4 5 B21R3.212 Oc1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000212099 [1,0,0,0,0,0|2,0,1]=4 6 B21R2.19004 O=C(CCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100011713675 [0,0,1,0,0,0|2,0,1]=4 7 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 11a_100000174871_100000731744 [0,0,1,0,0,0|2,0,1]=4 8 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 240690a_100000174871_100000731744 [0,0,1,0,0,0|2,0,1]=4 9 B21R2.19004 O=C(NCc1ccc(cc1)Cl)C(=Cc2cccnc2)F 527a_100000174871_100000731744 [0,0,1,0,0,0|2,0,1]=4 10 B21R2.19004 O=C(NNc1ccc(cc1)Cl)C(=Cc2cccnc2)F 22a_100000683521_100000731744 [0,0,1,0,0,0|3,0,0]=4 11 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 11a_100015205461_100000735890 [0,0,1,0,0,0|2,0,1]=4 12 B21R2.19177 C[C@@H](NC(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 240690a_100015205461_100000735890 [0,0,1,0,0,0|2,0,1]=4 13 B21R2.19177 Cc1ccc(cc1)C(=O)CC(=O)C=Cc2cccnc2 1458a_100000735890_100000211441 [0,0,1,0,0,0|3,0,0]=4 14 B21R2.19177 O=C(C=Cc1ccccc1)CC(=O)c2ccc(cc2)Cl 1458a_100000210462_100000211071 [0,0,1,0,0,0|3,0,0]=4 15 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2)Br 1458a_100000735890_100000188085 [0,0,1,0,0,0|2,1,0]=4 16 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2)Cl 1458a_100000735890_100000211071 [0,0,1,0,0,0|2,0,0]=3 17 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2)F 1458a_100000735890_100000211279 [0,0,1,0,0,0|2,1,0]=4 18 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2)I 1458a_100000735890_100011216261 [0,0,1,0,0,0|2,1,0]=4 19 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2)O 1458a_100000735890_100009814261 [0,0,1,0,0,0|3,0,0]=4 20 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cn2)Cl 1458a_100000735890_100016989621 [0,0,1,0,0,0|3,0,0]=4 21 B21R2.19177 O=C(C=Cc1cccnc1)CC(=O)c2ccc(nc2)Cl 1458a_100000735890_100009864725 [0,0,1,0,0,0|3,0,0]=4 22 B21R2.19177 O=C(C=Cc1cccnc1)CC(O)c2ccc(cc2)Cl 1458a_100000735890_200011996143 [0,0,1,0,0,0|2,0,1]=4 23 B21R3.29704 Cc1sc(nc1c2ccccc2)c3ccc(cc3)Cl 271570a_100011213355_100011830251 [0,0,0,0,1,0|2,1,0]=4 24 B23R3.15383 Cc1ccc(cc1)c2nc(c(o2)C)COc3cccnc3 34a_100000210849_200000068487 [0,0,0,0,0,1|2,0,1]=4 25 B23R3.15383 Cc1ccc(cc1)c2nc(c(o2)C)COc3cccnc3 7a_100000210849_200000068487 [0,0,0,0,0,1|2,0,1]=4 26 B23R3.15383 Cc1ccc(cc1)c2nc(c(o2)C)CSc3cccnc3 62a_100000210063_200000068487 [0,0,0,0,0,1|2,0,1]=4 27 B23R3.15383 Cc1ccc(cc1)c2nc(c(o2)C)CSc3cccnc3 62a_200000068487_100000210063 [0,0,0,0,0,1|2,0,1]=4 28 B20R2.4449 O=C(C=Cc1cccnc1)CCc2ccc(cc2)Cl 1458a_100000735890_100011713675 [1,0,1,0,0,0|1,0,1]=4 29 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 11a_100000174871_100000735890 [1,0,1,0,0,0|1,0,1]=4 30 B20R2.4449 O=C(C=Cc1cccnc1)NCc2ccc(cc2)Cl 240690a_100000174871_100000735890 [1,0,1,0,0,0|1,0,1]=4 31 B20R2.4449 O=C(C=Cc1cccnc1)NNc2ccc(cc2)Cl 22a_100000683521_100000735890 [1,0,1,0,0,0|2,0,0]=4 32 B20R2.21596 O=C(C=Cc1cccnc1)CC(=O)c2ccccc2 1458a_100000735890_100000211460 [1,0,1,0,0,0|2,0,0]=4 33 B20R3.2719 c1ccc(cc1)Sc2coc(n2)c3ccccc3 62a_100000719477_100010163736 [2,0,0,0,0,0|2,0,0]=4 34 B20R3.2719 c1ccc(cc1)Sc2coc(n2)c3ccccc3 62a_100010163736_100000041952 [2,0,0,0,0,0|2,0,0]=4 35 B20R3.2719 c1ccc(cc1)c2nc(c[nH]2)Sc3cccnc3 62a_100000210063_200010210587 [2,0,0,0,0,0|2,0,0]=4 36 B20R3.2719 c1ccc(cc1)c2nc(c[nH]2)Sc3cccnc3 62a_200010210587_100000210063 [2,0,0,0,0,0|2,0,0]=4 37 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnc3 62a_100000210063_100010163736 [2,0,0,0,0,0|1,0,0]=3 38 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnc3 62a_100010163736_100000210063 [2,0,0,0,0,0|1,0,0]=3 39 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnn3 62a_100010163736_100016991348 [2,0,0,0,0,0|2,0,0]=4 40 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cccnn3 62a_100016991348_100010163736 [2,0,0,0,0,0|2,0,0]=4 41 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3ccnnc3 62a_100000732662_100010163736 [2,0,0,0,0,0|2,0,0]=4 42 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3ccnnc3 62a_100010163736_100000732662 [2,0,0,0,0,0|2,0,0]=4 43 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cnccn3 62a_100000211759_100010163736 [2,0,0,0,0,0|2,0,0]=4 44 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cnccn3 62a_100010163736_100000211759 [2,0,0,0,0,0|2,0,0]=4 45 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cncnc3 62a_100010163736_100011206942 [2,0,0,0,0,0|2,0,0]=4 46 B20R3.2719 c1ccc(cc1)c2nc(co2)Sc3cncnc3 62a_100011206942_100010163736 [2,0,0,0,0,0|2,0,0]=4 47 B20R3.2719 c1ccc(cc1)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000185807 [2,0,0,0,0,0|1,0,1]=4 48 B20R3.2719 c1ccc(cc1)c2nc(no2)Sc3cccnc3 62a_100000210063_200000701163 [2,0,0,0,0,0|2,0,0]=4 49 B20R3.2719 c1ccc(cc1)c2nc(no2)Sc3cccnc3 62a_200000701163_100000210063 [2,0,0,0,0,0|2,0,0]=4 50 B22R2.22787 O=C(CC(=O)c1ccc(cc1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100000211071 [0,1,1,0,0,0|2,0,0]=4 51 B22R2.22799 CC(C(=O)C=Cc1cccnc1)C(=O)c2ccc(cc2)Cl 1458a_100000735890_100000183210 [0,1,1,0,0,0|2,0,0]=4 52 B22R2.23209 O=C(C=Cc1ccc(nc1)Br)CC(=O)c2ccc(cc2)Cl 1458a_100020588214_100000211071 [0,1,1,0,0,0|2,0,0]=4 53 B22R2.24196 Cc1cc(ccc1Cl)C(=O)CC(=O)C=Cc2cccnc2 1458a_100000735890_200011216723 [0,1,1,0,0,0|2,0,0]=4 54 B22R2.24196 O=C(C=Cc1cccnc1)CC(=O)c2ccc(c(c2)Cl)Cl 1458a_100000735890_100000211430 [0,1,1,0,0,0|2,0,0]=4 55 B22R2.24196 O=C(C=Cc1cccnc1)CC(=O)c2ccc(c(c2)F)Cl 1458a_100000735890_100012351892 [0,1,1,0,0,0|2,0,0]=4 56 B22R2.309253 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2Cl)Cl 1458a_100000735890_100000185731 [0,1,1,0,0,0|2,0,0]=4 57 B22R2.309253 O=C(C=Cc1cccnc1)CC(=O)c2ccc(cc2F)Cl 1458a_100000735890_100012351891 [0,1,1,0,0,0|2,0,0]=4 58 B22R3.1100 Cc1cc(ccc1Cl)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000686306 [1,1,0,0,0,0|1,0,1]=4 59 B22R3.1100 Clc1ccc(cc1Br)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000691181 [1,1,0,0,0,0|1,0,1]=4 60 B22R3.1100 Clc1ccc(cc1Cl)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000210401 [1,1,0,0,0,0|1,0,1]=4 61 B22R3.1100 Clc1ccc(cc1I)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000739381 [1,1,0,0,0,0|1,0,1]=4 62 B22R3.1100 Fc1cc(ccc1Cl)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000743183 [1,1,0,0,0,0|1,0,1]=4 63 B22R3.1100 Oc1cc(ccc1Cl)c2nc(no2)Cc3cccnc3 270196a_100011194494_100011933997 [1,1,0,0,0,0|1,0,1]=4 64 B22R3.32356 Cc1cc(ccc1c2nc(no2)Cc3cccnc3)Cl 270196a_100011194494_100000688705 [1,1,0,0,0,0|1,0,1]=4 65 B22R3.32356 Clc1ccc(c(c1)Br)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000766353 [1,1,0,0,0,0|1,0,1]=4 66 B22R3.32356 Clc1ccc(c(c1)I)c2nc(no2)Cc3cccnc3 270196a_100011194494_100000739380 [1,1,0,0,0,0|1,0,1]=4 67 B22R3.32356 Fc1cc(ccc1c2nc(no2)Cc3cccnc3)Cl 270196a_100011194494_100000212326 [1,1,0,0,0,0|1,0,1]=4 68 B22R3.32356 Oc1cc(ccc1c2nc(no2)Cc3cccnc3)Cl 270196a_100011194494_100000188622 [1,1,0,0,0,0|1,0,1]=4 69 B22R3.11026 Clc1ccc(cc1)c2noc(n2)C=Cc3cccnc3 270196a_100000184291_100000735890 [0,0,1,1,0,0|1,0,1]=4 70 B20R2.4447 O=C(Cc1ccc(cc1)Cl)C(=Cc2cccnc2)F 1458a_100000731744_100000694040 [0,0,1,0,1,0|1,0,1]=4 71 B20R2.4447 O=C(Nc1ccc(cc1)Cl)C(=Cc2cccnc2)F 11a_100000210052_100000731744 [0,0,1,0,1,0|2,0,0]=4 72 B20R2.4447 O=C(Nc1ccc(cc1)Cl)C(=Cc2cccnc2)F 22a_100000210052_100000731744 [0,0,1,0,1,0|2,0,0]=4 73 B20R2.4447 O=C(Nc1ccc(cc1)Cl)C(=Cc2cccnc2)F 527a_100000210052_100000731744 [0,0,1,0,1,0|2,0,0]=4 74 B20R2.15226 CC(C(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 1458a_100000735890_100000684792 [0,0,1,0,1,0|1,0,1]=4 75 B20R2.15226 CN(C(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 11a_100020629279_100000735890 [0,0,1,0,1,0|2,0,0]=4 76 B20R2.15226 CN(C(=O)C=Cc1cccnc1)c2ccc(cc2)Cl 22a_100020629279_100000735890 [0,0,1,0,1,0|2,0,0]=4 77 B20R3.152 Brc1ccc(cc1)c2nc(no2)c3cccnc3 270196a_100000188564_100000185839 [1,0,0,0,1,0|1,1,0]=4 78 B20R3.152 Cc1ccc(cc1)c2nc(no2)c3cccnc3 270196a_100000188564_100000188618 [1,0,0,0,1,0|2,0,0]=4 79 B20R3.152 Clc1ccc(cc1)c2ccc(s2)c3cccnc3 271570a_100011213355_100009816763 [1,0,0,0,1,0|2,0,0]=4 80 B20R3.152 Clc1ccc(cc1)c2nc(cs2)c3ccccc3 271570a_100011213355_100011830410 [1,0,0,0,1,0|1,1,0]=4 81 B20R3.152 Fc1ccc(cc1)c2nc(no2)c3cccnc3 270196a_100000188564_100000187176 [1,0,0,0,1,0|1,1,0]=4 82 B20R3.152 Ic1ccc(cc1)c2nc(no2)c3cccnc3 270196a_100000188564_100000187904 [1,0,0,0,1,0|1,1,0]=4 83 B20R3.152 Oc1ccc(cc1)c2nc(no2)c3cccnc3 270196a_100000188564_100000212099 [1,0,0,0,1,0|2,0,0]=4 84 B22R2.22797 O=C(C=Cc1cccnc1)NNC(=O)c2ccc(cc2)Cl 22a_100000184390_100000735890 [0,0,1,0,0,1|2,0,0]=4 85 B22R2.23723 O=C(C=Cc1cccnc1)CC(=O)Nc2ccc(cc2)Cl 1458a_100000735890_100000182960 [0,0,1,0,0,1|2,0,0]=4 86 B22R3.1145 Clc1ccc(cc1)Cc2nc(no2)Cc3cccnc3 270196a_100011194494_100000211027 [1,0,0,0,0,1|1,0,1]=4 87 B22R3.18201 Cc1oc(nc1COc2cccnc2)c3ccccc3 34a_100000210849_100000024931 [1,0,0,0,0,1|1,0,1]=4 88 B22R3.18201 Cc1oc(nc1COc2cccnc2)c3ccccc3 7a_100000210849_100000024931 [1,0,0,0,0,1|1,0,1]=4 89 B22R3.18201 Cc1oc(nc1CSc2cccnc2)c3ccccc3 62a_100000024931_100000210063 [1,0,0,0,0,1|1,0,1]=4 90 B22R3.18201 Cc1oc(nc1CSc2cccnc2)c3ccccc3 62a_100000210063_100000024931 [1,0,0,0,0,1|1,0,1]=4