0 B29R4.6396587 CC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-1221065892 [0,0,0,0,0,0|2,0,0]=2 1 B29R4.6396587 CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-5333952103 [0,0,0,0,0,0|3,0,1]=4 2 B29R4.6396587 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-1368810860 [0,0,0,0,0,0|1,0,1]=2 3 B29R4.6396587 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-2085210309 [0,0,0,0,0,0|1,0,1]=2 4 B29R4.6396587 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-5430038781 [0,0,0,0,0,0|2,0,1]=3 5 B29R4.6396587 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-6263580910 [0,0,0,0,0,0|2,0,1]=3 6 B29R4.6396587 O=N(=O)C1=CC=C(C=C1)OC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-8671138226 [0,0,0,0,0,0|1,0,2]=3 7 B28R4.85823 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-2884273766 [1,0,0,0,0,0|2,0,0]=3 8 B28R4.85823 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-4641474995 [1,0,0,0,0,0|2,0,0]=3 9 B28R4.85823 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=N4 MCULE-8237007355 [1,0,0,0,0,0|3,0,0]=4 10 B28R4.85823 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=NC=C4 MCULE-5925265654 [1,0,0,0,0,0|3,0,0]=4 11 B30R4.7795105 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=NC=C4 MCULE-4265001695 [0,1,0,0,0,0|2,0,1]=4 12 B30R4.7795105 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-2000526788 [0,1,0,0,0,0|1,0,1]=3 13 B30R4.7795105 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-8600718826 [0,1,0,0,0,0|1,0,1]=3 14 B30R4.7795105 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-4659238455 [0,1,0,0,0,0|2,0,1]=4 15 B30R4.7795105 COC(=O)C1=CC=C(C=C1)OC2=C3C=CC=CC3=NC(=N2)C4=CC=CC=C4 MCULE-8485097063 [0,1,0,0,0,0|2,0,1]=4 16 B30R4.11633107 NS(=O)(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-1196964607 [0,1,0,0,0,0|1,0,1]=3 17 B30R4.145341179 CC1=CC(=CC=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)N(C)C MCULE-2580776410 [0,1,0,0,0,0|2,0,1]=4 18 B30R4.145341179 CC1=CC(=CC=C1)C2=NC3=CC=CC=C3C(=N2)NC4=CC=C(C=C4)N(C)C MCULE-8522985633 [0,1,0,0,0,0|2,0,1]=4 19 B30R4.151984652 CC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=CC=C4O MCULE-5072416397 [0,1,0,0,0,0|2,0,0]=3 20 B30R4.151984652 CC1=CC=CC=C1C2=NC(=C3C=CC=CC3=N2)OC4=CC=C(C=C4)N(=O)=O MCULE-7364436311 [0,1,0,0,0,0|1,0,2]=4 21 B30R4.151984652 CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)Cl MCULE-3155750558 [0,1,0,0,0,0|2,0,1]=4 22 B30R4.151984652 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)Cl MCULE-5331419547 [0,1,0,0,0,0|1,0,1]=3 23 B30R4.151984652 O=C(O)C1=CC=C(C=C1)NC2=[NH+]C(=NC3=CC=CC=C23)C4=C(C=CC=C4)Cl MCULE-3770087683 [0,1,0,0,0,0|1,0,2]=4 24 B30R4.151984652 O=N(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)F MCULE-8937420055 [0,1,0,0,0,0|0,0,2]=3 25 B30R4.151984652 O=N(=O)C1=CC=C(C=C1)OC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)O MCULE-2482459596 [0,1,0,0,0,0|1,0,2]=4 26 B30R4.305942579 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Cl MCULE-2047343138 [0,1,0,0,0,0|1,0,1]=3 27 B30R4.305942579 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Cl MCULE-6516533533 [0,1,0,0,0,0|1,0,1]=3 28 B28R4.40049149 O=N(=O)C1=CC=C(C=C1)C2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-1485340303 [0,0,0,0,1,0|0,0,2]=3 29 B30R4.8204517 CC(=O)NC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-7023533191 [0,0,0,0,0,1|2,0,0]=3 30 B27R4.2315330 BrC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=N4 MCULE-6274937568 [2,0,0,0,0,0|2,0,0]=4 31 B27R4.2315330 CC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-7853457072 [2,0,0,0,0,0|1,0,0]=3 32 B27R4.2315330 CC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-9996131584 [2,0,0,0,0,0|1,0,0]=3 33 B27R4.2315330 CC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=N4 MCULE-6341675172 [2,0,0,0,0,0|2,0,0]=4 34 B27R4.2315330 CC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-4723703009 [2,0,0,0,0,0|2,0,0]=4 35 B27R4.2315330 CC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=NC=C4 MCULE-5045839097 [2,0,0,0,0,0|2,0,0]=4 36 B27R4.2315330 ClC1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CN=CC=C4 MCULE-2662283709 [2,0,0,0,0,0|2,0,0]=4 37 B27R4.2315330 FC1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CN=CC=C4 MCULE-6230099589 [2,0,0,0,0,0|2,0,0]=4 38 B27R4.2315330 FC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-3815853780 [2,0,0,0,0,0|1,0,0]=3 39 B27R4.2315330 FC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=N4 MCULE-1743353035 [2,0,0,0,0,0|2,0,0]=4 40 B27R4.2315330 FC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=NC=C4 MCULE-5854713689 [2,0,0,0,0,0|2,0,0]=4 41 B27R4.2315330 FC1=CC=C(C=C1)OC2=NC(=NC3=C2C=CC=C3)C4=CC=CC=C4 MCULE-8289945923 [2,0,0,0,0,0|2,0,0]=4 42 B27R4.2315330 IC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-7597808727 [2,0,0,0,0,0|2,0,0]=4 43 B27R4.2315330 OC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-5269265285 [2,0,0,0,0,0|0,0,1]=3 44 B27R4.2315330 OC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-1363825199 [2,0,0,0,0,0|1,0,1]=4 45 B27R4.2315330 OC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CN=C4 MCULE-2339747863 [2,0,0,0,0,0|1,0,1]=4 46 B29R4.100040 COC1=CC=C(C=C1)NC2=C3C=CC=CC3=NC(=N2)C4=CC=C(C=C4)C MCULE-1060019927 [1,1,0,0,0,0|2,0,0]=4 47 B29R4.100040 COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Br MCULE-9724380149 [1,1,0,0,0,0|2,0,0]=4 48 B29R4.100040 COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Cl MCULE-6699658694 [1,1,0,0,0,0|2,0,0]=4 49 B29R4.100040 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=C(C=C4)Cl MCULE-7597525376 [1,1,0,0,0,0|2,0,0]=4 50 B29R4.3650457 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)Cl MCULE-7666459077 [1,1,0,0,0,0|2,0,0]=4 51 B29R4.3650457 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=CC=C4)O MCULE-2917111638 [1,1,0,0,0,0|2,0,0]=4 52 B29R4.3650457 COC1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4F MCULE-5666923778 [1,1,0,0,0,0|2,0,0]=4 53 B29R4.32613361 COC1=CC=C(C=C1)NC2=NC(=NC3=CC(=CC=C23)Cl)C4=CC=CC=C4 MCULE-7346764744 [1,1,0,0,0,0|2,0,0]=4 54 B29R4.37018539 CC1=CC2=C(C=C1)N=C(N=C2C3=CC=C(C=C3)N(=O)=O)C4=CC=CC=C4 MCULE-4472270892 [0,1,0,0,1,0|0,0,2]=4 55 B31R4.11197637 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Br MCULE-6518964180 [0,2,0,0,0,0|1,0,1]=4 56 B31R4.11197637 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Cl MCULE-4888350663 [0,2,0,0,0,0|1,0,1]=4 57 B31R4.11197637 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=C2C=CC=C3)C4=CC=C(C=C4)Cl MCULE-6726887854 [0,2,0,0,0,0|1,0,1]=4 58 B31R4.11197637 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=C(C=C4)C MCULE-9252010358 [0,2,0,0,0,0|1,0,1]=4 59 B31R4.97194847 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4F MCULE-5607010543 [0,2,0,0,0,0|1,0,1]=4 60 B31R4.97194850 COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC(=C4)C MCULE-7535420038 [0,2,0,0,0,0|1,0,1]=4 61 B31R4.92240832 CC1=CC=C(C=C1)C2=NC3=C(C=CC=C3)C(=N2)NC4=C(C=C(C=C4)N(=O)=O)Cl MCULE-4846656197 [0,2,0,0,0,0|0,0,2]=4 62 B31R4.1419291023 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=C(C=C4)Cl)Cl MCULE-2760307216 [0,2,0,0,0,0|1,0,1]=4 63 B31R4.1419291023 O=C(O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C23)C4=C(C=C(C=C4)Cl)Cl MCULE-4869807849 [0,2,0,0,0,0|1,0,1]=4 64 B27R3.106653 O=[N+]([O-])C1=CC=C(C=C1)C=NN(CC2=CC=CC=C2)C3=CC=CC=C3 MCULE-3573146976 [0,0,1,0,1,0|2,0,0]=4 65 B27R3.106782 O=[N+]([O-])C1=CC=C(C=C1)C=NN=C(C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7068956983 [0,0,1,0,1,0|2,0,0]=4 66 B29R4.3575888 COC1=CC=C(C=C1)CNC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-4494028381 [1,0,0,0,0,1|2,0,0]=4 67 B29R4.6424331 CC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-5484070963 [0,0,0,0,1,1|2,0,0]=4 68 B29R4.6424331 CC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-7342820248 [0,0,0,0,1,1|2,0,0]=4 69 B29R4.6424331 O=C(O)C1=CC=CC(=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-1686315008 [0,0,0,0,1,1|1,0,1]=4 70 B29R4.6424331 O=C(O)C1=CC=CC(=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-4441360858 [0,0,0,0,1,1|1,0,1]=4 71 B29R4.6424331 O=N(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-6769385230 [0,0,0,0,1,1|0,0,2]=4 72 B29R4.6424331 O=N(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C23)C4=CC=CC=C4 MCULE-9341833002 [0,0,0,0,1,1|0,0,2]=4 73 B29R4.61222784 O=[N+]([O-])C1=CC=C(C=C1)C=CC2=NC(=C3N2C=CC=C3)C4=CC=CC=C4 MCULE-2859820793 [0,0,0,0,1,1|2,0,0]=4 74 B29R4.86989932 CC(=O)NC1=CC=C(C=C1)C2=C3C=CC=CC3=NC(=N2)C4=CC=CC=C4 MCULE-3666397139 [0,0,0,0,1,1|2,0,0]=4