0 B18R2.311 CC(=O)Nc1ccc(cc1)Oc2cccc[n]2 Amb22454403 [0,0,0,0,0,0|3,0,1]=4 1 B18R2.311 CC(=O)Oc1ccc(cc1)Nc2ccccc2 Amb2243399 [0,0,0,0,0,0|2,0,1]=3 2 B18R2.311 CC(C)Oc1ccc(cc1)Nc2cc[n]cc2 Amb18267737 [0,0,0,0,0,0|2,0,0]=2 3 B18R2.311 CC(C)Oc1ccc(cc1)Nc2cccc[n]2 Amb18267762 [0,0,0,0,0,0|2,0,0]=2 4 B18R2.311 CC(Cc1ccc(cc1)Oc2ccccc2)N Amb17142350 [0,0,0,0,0,0|3,0,0]=3 5 B18R2.311 CC(Nc1ccc(cc1)Nc2ccccc2)C Amb1541331 [0,0,0,0,0,0|0,0,0]=0 6 B18R2.311 CC(Oc1ccc(cc1)Cc2ccccc2)C Amb10808609 [0,0,0,0,0,0|2,0,0]=2 7 B18R2.311 CN(C)Cc1ccc(cc1)Nc2cc[n]cc2 Amb18931972 [0,0,0,0,0,0|3,0,0]=3 8 B18R2.311 CN(C)Cc1ccc(cc1)Nc2cccc[n]2 Amb18269169 [0,0,0,0,0,0|3,0,0]=3 9 B18R2.311 CN(C)Cc1ccc(cc1)Sc2ccccc2 Amb24309746 [0,0,0,0,0,0|3,0,0]=3 10 B18R2.311 FC(Oc1ccc(cc1)Oc2ccccc2)F Amb17252687 [0,0,0,0,0,0|4,0,0]=4 11 B18R2.311 NC(=N)Nc1ccc(cc1)Oc2ccccc2 Amb21858314 [0,0,0,0,0,0|3,0,1]=4 12 B18R2.311 NC(=S)Nc1ccc(cc1)Oc2ccccc2 Amb2372755 [0,0,0,0,0,0|3,0,1]=4 13 B18R2.311 OC(=O)Cc1ccc(cc1)Nc2ccccc2 Amb18267851 [0,0,0,0,0,0|3,0,1]=4 14 B17R2.9 BrCCc1ccc(cc1)Oc2ccccc2 Amb18888028 [1,0,0,0,0,0|3,0,0]=4 15 B17R2.9 CCOc1ccc(c[n]1)Sc2ccccc2 Amb24309564 [1,0,0,0,0,0|3,0,0]=4 16 B17R2.9 CCOc1ccc(cc1)Sc2ccccc2 Amb24105098 [1,0,0,0,0,0|2,0,0]=3 17 B17R2.9 CNCc1ccc(Cc2ccccc2)cc1 Amb18942267 [1,0,0,0,0,0|3,0,0]=4 18 B17R2.9 CNCc1ccc(Nc2ccccc2)[n]c1 Amb23446476 [1,0,0,0,0,0|3,0,0]=4 19 B17R2.9 ClCCc1ccc(cc1)Oc2ccccc2 Amb18869759 [1,0,0,0,0,0|3,0,0]=4 20 B17R2.9 N#CNc1ccc(cc1)Oc2ccccc2 Amb20080180 [1,0,0,0,0,0|2,0,1]=4 21 B17R2.9 NCCc1ccc(cc1)Cc2ccccc2 Amb17101798 [1,0,0,0,0,0|3,0,0]=4 22 B17R2.9 NCCc1ccc(cc1)Nc2cccc[n]2 Amb18255194 [1,0,0,0,0,0|3,0,0]=4 23 B17R2.9 NCCc1ccc(cc1)Oc2ccccc2 Amb22899448 [1,0,0,0,0,0|3,0,0]=4 24 B17R2.9 OCCc1c[n]c(cc1)Nc2ccccc2 Amb23446478 [1,0,0,0,0,0|3,0,0]=4 25 B17R2.9 OCCc1ccc(cc1)Oc2ccccc2 Amb17595815 [1,0,0,0,0,0|3,0,0]=4 26 B17R2.9 SCCc1ccc(cc1)Oc2ccccc2 Amb17472208 [1,0,0,0,0,0|3,0,0]=4 27 B19R2.2635 CC(C)C(=O)c1ccc(cc1)Nc2ccccc2 Amb18577158 [0,1,0,0,0,0|1,0,0]=2 28 B19R2.2635 CC(N)C(=O)c1ccc(cc1)Oc2ccccc2 Amb18577576 [0,1,0,0,0,0|3,0,0]=4 29 B19R2.2635 CN(C)C(=O)c1ccc(cc1)Nc2cc[n]cc2 Amb24298832 [0,1,0,0,0,0|3,0,0]=4 30 B19R2.2735 BrCC(=O)Nc1ccc(cc1)Oc2ccccc2 Amb17332205 [0,1,0,0,0,0|2,0,1]=4 31 B19R2.2735 CC(Nc1ccc(cc1)Oc2ccccc2)C#N Amb17409857 [0,1,0,0,0,0|1,0,1]=3 32 B19R2.2735 COC(=O)Cc1ccc(cc1)Nc2ccccc2 Amb18267608 [0,1,0,0,0,0|2,0,1]=4 33 B19R2.2735 ClCC(=O)Nc1ccc(cc1)Oc2ccccc2 Amb1201781 [0,1,0,0,0,0|2,0,1]=4 34 B19R2.2735 NCC(=O)Nc1ccc(cc1)Oc2ccccc2 Amb19136064 [0,1,0,0,0,0|2,0,1]=4 35 B19R2.2735 OCC(=O)Nc1ccc(cc1)Oc2ccccc2 Amb1110144 [0,1,0,0,0,0|2,0,1]=4 36 B19R2.2735 OCC(Oc1ccc(cc1)Oc2ccccc2)C Amb10610036 [0,1,0,0,0,0|2,0,0]=3 37 B19R2.4013 Cc1cc(ccc1OC(C)C)Nc2[n]ccc[n]2 Amb23681661 [0,1,0,0,0,0|3,0,0]=4 38 B19R2.4018 CC(C)NC=1C=NN(Cc2ccccc2)C(=O)C1 Amb24745340 [0,1,0,0,0,0|3,0,0]=4 39 B19R2.4018 CC(N)Cc1cc(F)c(cc1)Sc2ccccc2 Amb23974928 [0,1,0,0,0,0|3,0,0]=4 40 B19R2.4018 Cc1cc(CC(C)N)ccc1Sc2ccccc2 Amb23974974 [0,1,0,0,0,0|3,0,0]=4 41 B19R2.4344 CC(=O)Nc1ccc(cc1)Nc2nccc(c2)N Amb17349081 [0,1,0,0,0,0|2,0,1]=4 42 B19R2.4344 CC(C)Oc1ccc(cc1)NC=2NC(=O)C=CN2 Amb18525695 [0,1,0,0,0,0|3,0,0]=4 43 B19R2.4344 CC(C)Oc1ccc(cc1)Nc2cc(Cl)[n]c[n]2 Amb22432516 [0,1,0,0,0,0|3,0,0]=4 44 B19R2.4344 CC(C)Oc1ccc(cc1)Nc2cc(Cl)ccc2 Amb18930821 [0,1,0,0,0,0|1,0,0]=2 45 B19R2.4344 CC(C)Oc1ccc(cc1)Nc2cc(F)ccc2 Amb18267755 [0,1,0,0,0,0|1,0,0]=2 46 B19R2.4344 CC(C)Oc1ccc(cc1)Nc2cc[n]c(Cl)[n]2 Amb22432506 [0,1,0,0,0,0|3,0,0]=4 47 B19R2.4344 CC(Cc1ccc(cc1)Oc2cccc(c2)C)N Amb17159175 [0,1,0,0,0,0|3,0,0]=4 48 B19R2.4344 CC(Cc1ccc(cc1)Oc2cccc(c2)Cl)N Amb17163972 [0,1,0,0,0,0|3,0,0]=4 49 B19R2.4344 CC(Cc1ccc(cc1)Oc2cccc(c2)F)N Amb17159778 [0,1,0,0,0,0|3,0,0]=4 50 B19R2.4344 CC(Oc1ccc(cc1)Nc2nccc(c2)N)C Amb17349503 [0,1,0,0,0,0|2,0,0]=3 51 B19R2.4344 CN(C)Cc1ccc(cc1)Nc2cc(Cl)ccc2 Amb18931597 [0,1,0,0,0,0|2,0,0]=3 52 B19R2.4344 Cc1cc(Nc2ccc(cc2)OC(C)C)[n]c[n]1 Amb20288842 [0,1,0,0,0,0|3,0,0]=4 53 B19R2.4344 Cc1cc([n]c[n]1)Oc2ccc(cc2)NC(C)C Amb24279887 [0,1,0,0,0,0|3,0,0]=4 54 B19R2.4344 Cc1cc(ccc1)Sc2ccc(CC(C)N)cc2 Amb23975166 [0,1,0,0,0,0|3,0,0]=4 55 B19R2.7504 CC(=O)Nc1ccc(cc1)Nc2ccccc2N Amb18577652 [0,1,0,0,0,0|1,0,1]=3 56 B19R2.7504 CC(=O)Nc1ccc(cc1)Sc2ccccc2Cl Amb2439877 [0,1,0,0,0,0|2,0,1]=4 57 B19R2.7504 CC(N)Cc1ccc(cc1)Sc2ccccc2F Amb23975009 [0,1,0,0,0,0|3,0,0]=4 58 B19R2.7504 CN(C)Cc1ccc(cc1)Nc2ccccc2F Amb18931820 [0,1,0,0,0,0|2,0,0]=3 59 B19R2.7504 Cc1ccccc1Sc2ccc(CC(C)N)cc2 Amb23975108 [0,1,0,0,0,0|3,0,0]=4 60 B19R2.12215 CC(=O)Nc1ccc(cc1)Oc2ccc(cc2)N Amb2235158 [0,1,0,0,0,0|2,0,1]=4 61 B19R2.12215 CC(=O)Nc1ccc(cc1)Sc2ccc(cc2)Br Amb2439817 [0,1,0,0,0,0|2,0,1]=4 62 B19R2.12215 CC(=O)Nc1ccc(cc1)Sc2ccc(cc2)C Amb2437172 [0,1,0,0,0,0|2,0,1]=4 63 B19R2.12215 CC(=O)Nc1ccc(cc1)Sc2ccc(cc2)F Amb2437187 [0,1,0,0,0,0|2,0,1]=4 64 B19R2.12215 CC(C)Oc1ccc(cc1)Nc2ccc(Br)cc2 Amb22755268 [0,1,0,0,0,0|1,0,0]=2 65 B19R2.12215 CC(C)Oc1ccc(cc1)Nc2ccc(F)cc2 Amb18930830 [0,1,0,0,0,0|1,0,0]=2 66 B19R2.12215 CC(Cc1ccc(cc1)Oc2ccc(cc2)C)N Amb17159176 [0,1,0,0,0,0|3,0,0]=4 67 B19R2.12215 CC(Cc1ccc(cc1)Oc2ccc(cc2)Cl)N Amb17163973 [0,1,0,0,0,0|3,0,0]=4 68 B19R2.12215 CC(Cc1ccc(cc1)Oc2ccc(cc2)F)N Amb17159779 [0,1,0,0,0,0|3,0,0]=4 69 B19R2.12215 CC(N)Cc1ccc(cc1)Sc2ccc(Cl)cc2 Amb23974969 [0,1,0,0,0,0|3,0,0]=4 70 B19R2.12215 CC(N)Cc1ccc(cc1)Sc2ccc(F)cc2 Amb23975002 [0,1,0,0,0,0|3,0,0]=4 71 B19R2.12215 CN(C)Cc1ccc(cc1)Nc2ccc(Cl)cc2 Amb18268628 [0,1,0,0,0,0|2,0,0]=3 72 B19R2.12215 CN(C)Cc1ccc(cc1)Nc2ccc(F)cc2 Amb18931791 [0,1,0,0,0,0|2,0,0]=3 73 B19R2.13479 CC(C)Cc1ccc(cc1)C(O)c2ccccc2 Amb23925683 [0,1,0,0,0,0|2,0,0]=3 74 B19R2.13479 CC(C)Nc1ccc(c[n]1)C(=O)c2ccccc2 Amb23446278 [0,1,0,0,0,0|2,0,0]=3 75 B19R2.13479 CC(C)Nc1ccc(c[n]1)C(N)c2ccccc2 Amb23446283 [0,1,0,0,0,0|2,0,0]=3 76 B19R2.13479 CC(C)Nc1ccc(c[n]1)C(O)c2ccccc2 Amb23445971 [0,1,0,0,0,0|2,0,0]=3 77 B19R2.13479 CN(Cc1ccc(cc1)C(c2ccccc2)N)C Amb17320035 [0,1,0,0,0,0|3,0,0]=4 78 B19R2.49535 CC(C)(C)Oc1ccc(cc1)Nc2c[n]c[n]c2 Amb18930701 [0,1,0,0,0,0|3,0,0]=4 79 B19R2.49535 CC(C)(C)Oc1ccc(cc1)Nc2c[n]ccc2 Amb18930704 [0,1,0,0,0,0|2,0,0]=3 80 B19R2.49535 CC(C)(C)Oc1ccc(cc1)Nc2ccccc2 Amb18267581 [0,1,0,0,0,0|1,0,0]=2 81 B19R2.49535 CC(C)(C)Sc1c[n]c(cc1)Nc2ccccc2 Amb23446477 [0,1,0,0,0,0|2,0,0]=3 82 B19R2.49535 CC(C)(C)Sc1c[n]c(cc1)Oc2ccccc2 Amb23446371 [0,1,0,0,0,0|3,0,0]=4 83 B19R2.49535 CC(C)(C)Sc1c[n]c(cc1)Sc2ccccc2 Amb23446387 [0,1,0,0,0,0|3,0,0]=4 84 B19R2.49535 CC(C)(N)Cc1ccc(cc1)Oc2ccccc2 Amb18577704 [0,1,0,0,0,0|2,0,0]=3 85 B19R2.49535 CS(=O)(=O)Nc1ccc(cc1)Nc2ccccc2 Amb16205166 [0,1,0,0,0,0|2,0,0]=3 86 B19R2.49535 C[Si](C)(C)Oc1ccc(Cc2ccccc2)cc1 Amb24074058 [0,1,0,0,0,0|2,1,0]=4 87 B19R3.256 CN1Cc2cc(ccc2C1)Nc3cccc[n]3 Amb18930995 [0,0,0,1,0,0|3,0,0]=4 88 B19R3.256 CN1Cc2ccc(cc2C1)Nc3cc[n]cc3 Amb18268014 [0,0,0,1,0,0|3,0,0]=4 89 B19R3.256 Cc1cc2cc(ccc2[nH]1)Oc3ccccc3 Amb18246003 [0,0,0,1,0,0|1,0,2]=4 90 B19R3.256 O=C1Cc2cc(ccc2N1)Oc3ccccc3 Amb18896979 [0,0,0,1,0,0|2,0,1]=4 91 B19R3.202037 CC(=O)Nc1ccc2c(c1)c3ccccc3[nH]2 Amb2571580 [0,0,0,1,0,0|1,0,1]=3 92 B19R3.202037 CC(=O)Nc1ccc2c(c1)c3ccccc3o2 Amb166902 [0,0,0,1,0,0|2,0,1]=4 93 B19R3.202037 CC(N)Cc1cc2c(cc1)oc3ccccc23 Amb22284186 [0,0,0,1,0,0|3,0,0]=4 94 B17R2.141 CC(=O)c1ccc(cc1)Nc2c[n]ccc2 Amb18268527 [0,0,0,0,1,0|2,0,1]=4 95 B17R2.141 CC(=O)c1ccc(cc1)Oc2ccccc2 Amb1196783 [0,0,0,0,1,0|2,0,1]=4 96 B17R2.141 CC(=O)c1ccc(cc1)Sc2ccccc2 Amb16206168 [0,0,0,0,1,0|2,0,1]=4 97 B17R2.141 CC(=O)c1ccc(cc1)Sc2ccccc2 Amb2415056 [0,0,0,0,1,0|2,0,1]=4 98 B17R2.141 CC(C)c1ccc(cc1)Nc2ccccc2 Amb22171397 [0,0,0,0,1,0|0,0,0]=1 99 B17R2.141 CC(N)c1c[n]c(cc1)Nc2ccccc2 Amb23446470 [0,0,0,0,1,0|2,0,0]=3 100 B17R2.141 CC(N)c1c[n]c(cc1)Oc2ccccc2 Amb23446366 [0,0,0,0,1,0|3,0,0]=4 101 B17R2.141 CC(N)c1c[n]c(cc1)Sc2ccccc2 Amb23446382 [0,0,0,0,1,0|3,0,0]=4 102 B17R2.141 CC(O)c1c[n]c(cc1)Nc2ccccc2 Amb23446467 [0,0,0,0,1,0|2,0,0]=3 103 B17R2.141 CC(O)c1c[n]c(cc1)Oc2ccccc2 Amb23446363 [0,0,0,0,1,0|3,0,0]=4 104 B17R2.141 CC(O)c1c[n]c(cc1)Sc2ccccc2 Amb23446379 [0,0,0,0,1,0|3,0,0]=4 105 B17R2.141 CC(O)c1ccc(cc1)Sc2ccccc2 Amb24080102 [0,0,0,0,1,0|2,0,0]=3 106 B17R2.141 CC(c1ccc(cc1)Cc2ccccc2)O Amb17595749 [0,0,0,0,1,0|2,0,0]=3 107 B17R2.141 CN(C)c1ccc(cc1)Nc2c[n]ccc2 Amb18269145 [0,0,0,0,1,0|2,0,0]=3 108 B17R2.141 CN(C)c1ccc(cc1)Nc2cc[n]cc2 Amb18269101 [0,0,0,0,1,0|2,0,0]=3 109 B17R2.141 CN(c1cc[n+](cc1)Cc2ccccc2)C Amb10560586 [0,0,0,0,1,0|3,0,0]=4 110 B17R2.141 CN(c1ccc(cc1)Cc2ccccc2)C Amb10560349 [0,0,0,0,1,0|2,0,0]=3 111 B17R2.141 OC(=O)c1ccc(cc1)Nc2ccccc2 Amb22477324 [0,0,0,0,1,0|2,0,1]=4 112 B17R2.141 [O-][N+](=O)c1ccc(cc1)Nc2ccccc2 Amb1869296 [0,0,0,0,1,0|3,0,0]=4 113 B17R2.245 CC(C)Nc1c[n](Cc2ccccc2)[n]c1 Amb19006195 [0,0,0,0,1,0|3,0,0]=4 114 B17R2.246 CC(=O)Cc1ccc(cc1)c2ccccc2 Amb1107872 [0,0,0,0,1,0|2,0,1]=4 115 B17R2.246 CC(=O)Nc1ccc(cc1)c2ccccc2 Amb1209779 [0,0,0,0,1,0|1,0,1]=3 116 B17R2.246 CC(=O)Nc1ccc(cn1)c2ccccc2 Amb11491367 [0,0,0,0,1,0|2,0,1]=4 117 B17R2.246 CC(Br)Cc1ccc(cc1)-c2ccccc2 Amb18548893 [0,0,0,0,1,0|2,0,0]=3 118 B17R2.246 CC(C)Oc1ccc(cc1)-c2cc[n]c[n]2 Amb19590390 [0,0,0,0,1,0|3,0,0]=4 119 B17R2.246 CC(Cc1ccc(cc1)c2ccccc2)N Amb10609180 [0,0,0,0,1,0|2,0,0]=3 120 B17R2.246 CC(Cl)Cc1ccc(cc1)-c2ccccc2 Amb18049951 [0,0,0,0,1,0|2,0,0]=3 121 B17R2.246 CC(N)Cc1ccc(cc1)-c2cc[n]cc2 Amb18935241 [0,0,0,0,1,0|3,0,0]=4 122 B17R2.246 CC(Sc1ccc(nn1)c2ccccc2)C Amb10891157 [0,0,0,0,1,0|3,0,0]=4 123 B17R2.246 C\[N+](\[O-])=C\c1ccc(cc1)-c2ccccc2 Amb24272213 [0,0,0,0,1,0|3,0,0]=4 124 B17R2.246 FC(Oc1ccc(cc1)c2ccccc2)F Amb17244115 [0,0,0,0,1,0|3,0,0]=4 125 B19R2.4606 CC(C)NCc1ccc(cc1)Sc2[n]ccc[n]2 Amb23974140 [0,0,0,0,0,1|3,0,0]=4 126 B19R2.4606 CC(C)NCc1ccc(cc1)Sc2c[n]cc[n]2 Amb23974271 [0,0,0,0,0,1|3,0,0]=4 127 B19R2.4606 CC(C)NCc1ccc(cc1)Sc2cccc[n]2 Amb23974083 [0,0,0,0,0,1|2,0,0]=3 128 B19R2.4606 CC(COc1ccc(cc1)Oc2ccccc2)C Amb1197520 [0,0,0,0,0,1|2,0,0]=3 129 B19R2.4606 CN(\N=N\c1ccc(cc1)Oc2ccccc2)C Amb1780043 [0,0,0,0,0,1|2,0,1]=4 130 B19R2.13470 CC(=O)Nc1ccc(cc1)SCc2ccccc2 Amb1190512 [0,0,0,0,0,1|2,0,1]=4 131 B19R2.13470 CC(=O)Nc1ccc(cc1)\N=C\c2ccccc2 Amb1204248 [0,0,0,0,0,1|1,0,2]=4 132 B19R2.13470 CC(=O)Oc1ccc(cc1)NCc2ccccc2 Amb18929220 [0,0,0,0,0,1|2,0,1]=4 133 B19R2.13470 CC(N)Cc1ccc(cc1)OCc2ccccc2 Amb22484005 [0,0,0,0,0,1|3,0,0]=4 134 B19R2.13470 CC(N)Cc1ccc(cc1)SCc2ccccc2 Amb23974991 [0,0,0,0,0,1|3,0,0]=4 135 B19R2.13470 CC(Nc1ccc(cc1)OCc2ccccc2)C Amb17306942 [0,0,0,0,0,1|1,0,0]=2 136 B16R2.2 C=Nc1ccc(cc1)Nc2ccccc2 Amb24103010 [2,0,0,0,0,0|0,0,2]=4 137 B16R2.2 CCc1ccc(Cc2ccccc2)cc1 Amb24064562 [2,0,0,0,0,0|1,0,0]=3 138 B16R2.2 CNc1ccc(cc1)Cc2ccccc2 Amb10560353 [2,0,0,0,0,0|1,0,0]=3 139 B16R2.2 CNc1ccc(cc1)Nc2ccccc2 Amb10559806 [2,0,0,0,0,0|0,0,0]=2 140 B16R2.2 CNc1ccc(cc1)Oc2cc[n]cc2 Amb18972061 [2,0,0,0,0,0|2,0,0]=4 141 B16R2.2 CNc1ccc(cc1)Oc2cccc[n]2 Amb18982311 [2,0,0,0,0,0|2,0,0]=4 142 B16R2.2 COc1ccc(cc1)Nc2c[n]ccc2 Amb18932004 [2,0,0,0,0,0|2,0,0]=4 143 B16R2.2 COc1ccc(cc1)Nc2ccccc2 Amb1208565 [2,0,0,0,0,0|1,0,0]=3 144 B16R2.2 ClCc1c[n]c(cc1)Nc2ccccc2 Amb23446457 [2,0,0,0,0,0|2,0,0]=4 145 B16R2.2 ClCc1ccc(Cc2ccccc2)cc1 Amb19958841 [2,0,0,0,0,0|2,0,0]=4 146 B16R2.2 ClCc1ccc(cc1)Sc2ccccc2 Amb16234162 [2,0,0,0,0,0|2,0,0]=4 147 B16R2.2 N#[N+]c1ccc(cc1)Nc2ccccc2 Amb22167447 [2,0,0,0,0,0|1,0,1]=4 148 B16R2.2 N#[N+]c1ccc(cc1)Nc2ccccc2 Amb22731105 [2,0,0,0,0,0|1,0,1]=4 149 B16R2.2 N=[NH+]c1ccc(cc1)Nc2ccccc2 Amb16227051 [2,0,0,0,0,0|1,0,1]=4 150 B16R2.2 NCc1c[n]c(cc1)Nc2ccccc2 Amb18566173 [2,0,0,0,0,0|2,0,0]=4 151 B16R2.2 NCc1ccc(cc1)Cc2ccccc2 Amb17101774 [2,0,0,0,0,0|2,0,0]=4 152 B16R2.2 NCc1ccc(cc1)Nc2cccc[n]2 Amb18917291 [2,0,0,0,0,0|2,0,0]=4 153 B16R2.2 NNc1ccc(Cc2ccccc2)cc1 Amb24063605 [2,0,0,0,0,0|2,0,0]=4 154 B16R2.2 NNc1ccc(Oc2ccccc2)cc1 Amb17935625 [2,0,0,0,0,0|2,0,0]=4 155 B16R2.2 OCc1c[n]c(cc1)Nc2ccccc2 Amb23446461 [2,0,0,0,0,0|2,0,0]=4 156 B16R2.2 OCc1ccc(Cc2ccccc2)cc1 Amb22295899 [2,0,0,0,0,0|2,0,0]=4 157 B18R2.4 CCNc1ccc(Cc2ccc(N)cc2)cc1 Amb18659527 [1,1,0,0,0,0|1,0,0]=3 158 B18R2.28 C=CCNc1ccc(cc1)Oc2ccccc2 Amb17306637 [1,1,0,0,0,0|1,0,1]=4 159 B18R2.28 CCCCc1ccc(cc1)Nc2ccccc2 Amb17933576 [1,1,0,0,0,0|1,0,0]=3 160 B18R2.28 CCNCc1c[n]c(cc1)Oc2ccccc2 Amb23945622 [1,1,0,0,0,0|2,0,0]=4 161 B18R2.28 CCNCc1ccc(Cc2ccccc2)cc1 Amb18942266 [1,1,0,0,0,0|1,0,0]=3 162 B18R2.28 CNCCc1ccc(Cc2ccccc2)cc1 Amb18942278 [1,1,0,0,0,0|2,0,0]=4 163 B18R2.28 CNCCc1ccc(cc1)Oc2ccccc2 Amb16230490 [1,1,0,0,0,0|2,0,0]=4 164 B18R2.28 COCOc1ccc(Cc2ccccc2)cc1 Amb22227867 [1,1,0,0,0,0|2,0,0]=4 165 B18R2.28 NCCCc1ccc(cc1)Oc2ccccc2 Amb18555254 [1,1,0,0,0,0|2,0,0]=4 166 B18R2.28 NCCNc1ccc(cc1)Oc2ccccc2 Amb17091072 [1,1,0,0,0,0|1,0,0]=3 167 B18R2.28 NCCNc1ccc(cc1)Oc2ccccc2 Amb18897079 [1,1,0,0,0,0|1,0,0]=3 168 B18R2.287 CCC(=O)c1c[n]c(cc1)Nc2ccccc2 Amb23446465 [1,1,0,0,0,0|2,0,0]=4 169 B18R2.287 CCC(=O)c1ccc(Cc2ccccc2)cc1 Amb18555258 [1,1,0,0,0,0|2,0,0]=4 170 B18R2.287 CCC(=O)c1ccc(cc1)Nc2ccccc2 Amb18571270 [1,1,0,0,0,0|1,0,0]=3 171 B18R2.287 CCC(N)c1c[n]c(cc1)Nc2ccccc2 Amb23446471 [1,1,0,0,0,0|2,0,0]=4 172 B18R2.287 CCC(O)c1c[n]c(cc1)Nc2ccccc2 Amb23446468 [1,1,0,0,0,0|2,0,0]=4 173 B18R2.2461 CCNc1ccc(Cc2ccccc2N)cc1 Amb24094288 [1,1,0,0,0,0|1,0,0]=3 174 B18R2.2461 CCOc1ccc(cc1)Oc2ccccc2N Amb1208485 [1,1,0,0,0,0|2,0,0]=4 175 B18R2.2461 CCOc1ccc(cc1)Oc2ccccc2N Amb22049633 [1,1,0,0,0,0|2,0,0]=4 176 B18R2.3815 CCCc1ccc(cc1)C(c2ccccc2)O Amb10808667 [1,1,0,0,0,0|2,0,0]=4 177 B18R2.3815 CCNc1ccc(nc1)N(c2ccccc2)C Amb17318018 [1,1,0,0,0,0|1,0,0]=3 178 B18R2.3815 CCOc1ccc(cc1)C(c2ccccc2)O Amb17248159 [1,1,0,0,0,0|2,0,0]=4 179 B18R2.3815 CCOc1ccc(cc1)N(C)c2ccccc2 Amb24091511 [1,1,0,0,0,0|1,0,0]=3 180 B18R2.3815 CN(c1ccccc1)c2ccc(CCN)cc2 Amb18571482 [1,1,0,0,0,0|2,0,0]=4 181 B18R2.3815 CN(c1ccccc1)c2ccc(CCO)cc2 Amb18070351 [1,1,0,0,0,0|2,0,0]=4 182 B18R2.3825 CCOc1ccc(cc1N)Oc2ccccc2 Amb18555850 [1,1,0,0,0,0|2,0,0]=4 183 B18R2.3839 CCOc1ccc(cc1)Nc2nccc(c2)N Amb17344328 [1,1,0,0,0,0|2,0,0]=4 184 B18R2.7634 Cc1cc(ccc1Nc2ccccc2)OCC Amb24091483 [1,1,0,0,0,0|1,0,0]=3 185 B18R2.7634 NCCc1cc(F)c(cc1)Nc2ccccc2 Amb18572589 [1,1,0,0,0,0|2,0,0]=4 186 B18R2.2633 CC(C)(N)c1ccc(cc1)Oc2ccccc2 Amb18571592 [0,1,0,0,1,0|1,0,0]=3 187 B18R2.2633 CC(F)(F)c1ccc(Cc2ccccc2)cc1 Amb20669893 [0,1,0,0,1,0|2,0,0]=4 188 B18R2.2633 C[Si](C)(C)c1ccc(Cc2ccccc2)cc1 Amb25082128 [0,1,0,0,1,0|1,1,0]=4 189 B18R2.2633 C[Si](C)(C)c1ccc(cc1)Nc2ccccc2 Amb22497420 [0,1,0,0,1,0|0,1,0]=3 190 B18R2.2633 C[Si](C)(C)c1ccc(cc1)Oc2ccccc2 Amb19886429 [0,1,0,0,1,0|1,1,0]=4 191 B18R2.2633 FC(F)(F)c1ccc(cc1)Nc2ccccc2 Amb22749895 [0,1,0,0,1,0|2,0,0]=4 192 B18R2.3631 CC(O)c1ccc(cc1Cl)Oc2ccccc2 Amb23983963 [0,1,0,0,1,0|2,0,0]=4 193 B18R2.3631 CN(c1ccc(cc1N)Cc2ccccc2)C Amb17142203 [0,1,0,0,1,0|2,0,0]=4 194 B18R2.3631 Cc1[n]c(ccc1C(C)N)Nc2ccccc2 Amb23445765 [0,1,0,0,1,0|2,0,0]=4 195 B18R2.3631 Cc1[n]c(ccc1C(C)O)Nc2ccccc2 Amb23445761 [0,1,0,0,1,0|2,0,0]=4 196 B18R2.3631 Cc1cc(Nc2ccccc2)[n]cc1C(C)N Amb23579558 [0,1,0,0,1,0|2,0,0]=4 197 B18R2.3631 Cc1cc(Nc2ccccc2)[n]cc1C(C)O Amb23579555 [0,1,0,0,1,0|2,0,0]=4 198 B18R2.3632 CC(=O)c1cc(F)c(cc1)Nc2ccccc2 Amb18572044 [0,1,0,0,1,0|1,0,1]=4 199 B18R2.3632 CC(=O)c1cc(N)c(cc1)Nc2ccccc2 Amb18867673 [0,1,0,0,1,0|1,0,1]=4 200 B18R2.3632 CC(N)c1cc(Cl)c(cc1)Oc2ccccc2 Amb21984371 [0,1,0,0,1,0|2,0,0]=4 201 B18R2.3632 CC(N)c1cc(Cl)c(cc1)Sc2ccccc2 Amb21984370 [0,1,0,0,1,0|2,0,0]=4 202 B18R2.3632 CC(O)c1cc(Cl)c(cc1)Oc2ccccc2 Amb21984361 [0,1,0,0,1,0|2,0,0]=4 203 B18R2.3632 CC(O)c1cc(Cl)c(cc1)Sc2ccccc2 Amb21984360 [0,1,0,0,1,0|2,0,0]=4 204 B18R2.3632 CC(O)c1cc(F)c(cc1)Sc2ccccc2 Amb23974552 [0,1,0,0,1,0|2,0,0]=4 205 B18R2.3632 C[C@@H](O)c1cc(Cl)c(cc1)Sc2ccccc2 Amb23974551 [0,1,0,0,1,0|2,0,0]=4 206 B18R2.3632 C[C@@H](O)c1cc(F)c(cc1)Sc2ccccc2 Amb23974548 [0,1,0,0,1,0|2,0,0]=4 207 B18R2.3632 Cc1cc(c[n]c1Nc2ccccc2)C(C)N Amb23578787 [0,1,0,0,1,0|2,0,0]=4 208 B18R2.3632 Cc1cc(c[n]c1Nc2ccccc2)C(C)O Amb23578784 [0,1,0,0,1,0|2,0,0]=4 209 B18R2.3887 CC(O)c1ccc(cc1)Sc2cc(Br)ccc2 Amb23974811 [0,1,0,0,1,0|2,0,0]=4 210 B18R2.3887 CC(O)c1ccc(cc1)Sc2cc(Cl)ccc2 Amb23974792 [0,1,0,0,1,0|2,0,0]=4 211 B18R2.3887 CC(c1ccc(cc1)Nc2nccc(c2)N)C Amb17343866 [0,1,0,0,1,0|1,0,0]=3 212 B18R2.3887 CN(C)c1ccc(cc1)Nc2cc(Cl)ccc2 Amb18268670 [0,1,0,0,1,0|1,0,0]=3 213 B18R2.3887 CN(C)c1ccc(cc1)Nc2cc(F)ccc2 Amb18931772 [0,1,0,0,1,0|1,0,0]=3 214 B18R2.3887 CN(C)c1ccc(cc1)Nc2cc(O)ccc2 Amb18268980 [0,1,0,0,1,0|1,0,0]=3 215 B18R2.3887 C[C@@H](O)c1ccc(cc1)Sc2cc(Cl)ccc2 Amb23974786 [0,1,0,0,1,0|2,0,0]=4 216 B18R2.3887 Cc1cc(ccc1)Sc2ccc(cc2)C(C)O Amb23974874 [0,1,0,0,1,0|2,0,0]=4 217 B18R2.3887 Cc1cc(ccc1)Sc2ccc(cc2)[C@@H](C)O Amb23974870 [0,1,0,0,1,0|2,0,0]=4 218 B18R2.3887 Cc1cccc(c1)Cc2ccc(cc2)C(N)C Amb17101845 [0,1,0,0,1,0|2,0,0]=4 219 B18R2.3887 Clc1cccc(c1)Cc2ccc(cc2)C(N)C Amb17101851 [0,1,0,0,1,0|2,0,0]=4 220 B18R2.3887 Fc1cccc(c1)Cc2ccc(cc2)C(N)C Amb17101848 [0,1,0,0,1,0|2,0,0]=4 221 B18R2.3887 Nc1cccc(c1)Cc2ccc(cc2)C(C)C Amb17142106 [0,1,0,0,1,0|1,0,0]=3 222 B18R2.6290 CC(=O)c1ccc(cc1)Nc2ccccc2Cl Amb18931389 [0,1,0,0,1,0|1,0,1]=4 223 B18R2.6290 CC(=O)c1ccc(cc1)Nc2ccccc2F Amb18931395 [0,1,0,0,1,0|1,0,1]=4 224 B18R2.6290 CC(=O)c1ccc(cc1)Nc2ccccc2N Amb18571458 [0,1,0,0,1,0|1,0,1]=4 225 B18R2.6290 CC(C)c1ccc(cc1)[SH2]c2ccccc2N Amb18541314 [0,1,0,0,1,0|1,0,0]=3 226 B18R2.6290 CC(O)c1ccc(cc1)Sc2ccccc2Br Amb23974719 [0,1,0,0,1,0|2,0,0]=4 227 B18R2.6290 CC(O)c1ccc(cc1)Sc2ccccc2F Amb23974606 [0,1,0,0,1,0|2,0,0]=4 228 B18R2.6290 CN(C)c1ccc(cc1)Oc2ccccc2N Amb18061996 [0,1,0,0,1,0|2,0,0]=4 229 B18R2.6290 CN/1C=CC=C\C1=N/c2ccc(cc2)C(C)C Amb19278133 [0,1,0,0,1,0|1,0,1]=4 230 B18R2.6290 C[C@@H](O)c1ccc(cc1)Sc2ccccc2Br Amb23974713 [0,1,0,0,1,0|2,0,0]=4 231 B18R2.6290 C[C@@H](O)c1ccc(cc1)Sc2ccccc2Cl Amb23974616 [0,1,0,0,1,0|2,0,0]=4 232 B18R2.6290 C[C@@H](O)c1ccc(cc1)Sc2ccccc2F Amb23974603 [0,1,0,0,1,0|2,0,0]=4 233 B18R2.6290 Cc1ccccc1Cc2ccc(cc2)C(N)C Amb17101844 [0,1,0,0,1,0|2,0,0]=4 234 B18R2.6290 Cc1ccccc1Sc2ccc(cc2)C(C)O Amb23974764 [0,1,0,0,1,0|2,0,0]=4 235 B18R2.6290 Cc1ccccc1Sc2ccc(cc2)[C@@H](C)O Amb23974760 [0,1,0,0,1,0|2,0,0]=4 236 B18R2.6290 Clc1ccccc1Cc2ccc(cc2)C(N)C Amb17101850 [0,1,0,0,1,0|2,0,0]=4 237 B18R2.6290 Fc1ccccc1Cc2ccc(cc2)C(N)C Amb17101847 [0,1,0,0,1,0|2,0,0]=4 238 B18R2.6290 Nc1ccccc1Cc2ccc(cc2)C(C)C Amb17142110 [0,1,0,0,1,0|1,0,0]=3 239 B18R2.7085 CC(N)c1c[n]c(cc1)N(C)c2ccccc2 Amb23446489 [0,1,0,0,1,0|2,0,0]=4 240 B18R2.7085 CC(O)c1c[n]c(cc1)N(C)c2ccccc2 Amb23446487 [0,1,0,0,1,0|2,0,0]=4 241 B18R2.7085 CC(c1ccc(cc1)C(=O)c2ccccc2)N Amb17101619 [0,1,0,0,1,0|2,0,0]=4 242 B18R2.7085 CC(c1ccccc1)c2ccc(cc2)N(C)C Amb10560355 [0,1,0,0,1,0|2,0,0]=4 243 B18R2.7085 CN(c1ccc(cc1)C(=O)c2ccccc2)C Amb1208391 [0,1,0,0,1,0|2,0,0]=4 244 B18R2.7085 C[C@@H](N)c1ccc(cc1)C(=O)c2ccccc2 Amb24088235 [0,1,0,0,1,0|2,0,0]=4 245 B18R2.7085 C[C@H](N)c1ccc(cc1)C(=O)c2ccccc2 Amb24088236 [0,1,0,0,1,0|2,0,0]=4 246 B18R2.7085 OC(c1ccccc1)c2ccc(cc2)C(C)C Amb17247419 [0,1,0,0,1,0|1,0,0]=3 247 B18R2.7085 OC(c1ccccc1)c2ccc(cc2)N(C)C Amb1110874 [0,1,0,0,1,0|2,0,0]=4 248 B18R2.7085 OC(c1cccnc1)c2ccc(cc2)C(C)C Amb17247778 [0,1,0,0,1,0|2,0,0]=4 249 B18R2.9194 Brc1ccc(cc1)Sc2ccc(cc2)N(C)C Amb2439835 [0,1,0,0,1,0|2,0,0]=4 250 B18R2.9194 CC(=O)c1ccc(cc1)Nc2ccc(Cl)cc2 Amb18268515 [0,1,0,0,1,0|1,0,1]=4 251 B18R2.9194 CC(C)c1ccc(cc1)[SH2]c2ccc(N)cc2 Amb18541313 [0,1,0,0,1,0|1,0,0]=3 252 B18R2.9194 CN(C)c1ccc(cc1)Nc2ccc(Cl)cc2 Amb18268637 [0,1,0,0,1,0|1,0,0]=3 253 B18R2.9194 CN(C)c1ccc(cc1)Nc2ccc(O)cc2 Amb18268947 [0,1,0,0,1,0|1,0,0]=3 254 B18R2.9194 CN(C)c1ccc(cc1)Oc2ccc(N)cc2 Amb18061990 [0,1,0,0,1,0|2,0,0]=4 255 B18R2.9194 C[C@@H](O)c1ccc(cc1)Sc2ccc(Br)cc2 Amb23974697 [0,1,0,0,1,0|2,0,0]=4 256 B18R2.9194 Cc1ccc(cc1)Cc2ccc(cc2)C(N)C Amb17101846 [0,1,0,0,1,0|2,0,0]=4 257 B18R2.9194 Cc1ccc(cc1)Nc2ccc(cc2)C(C)C Amb19958307 [0,1,0,0,1,0|0,0,0]=2 258 B18R2.9194 Cc1ccc(cc1)Sc2ccc(cc2)C(C)O Amb23974595 [0,1,0,0,1,0|2,0,0]=4 259 B18R2.9194 Clc1ccc(cc1)Cc2ccc(cc2)C(N)C Amb17101852 [0,1,0,0,1,0|2,0,0]=4 260 B18R2.9194 Fc1ccc(cc1)Cc2ccc(cc2)C(N)C Amb17101849 [0,1,0,0,1,0|2,0,0]=4 261 B18R2.9194 Nc1ccc(cc1)Cc2ccc(cc2)C(C)C Amb17142105 [0,1,0,0,1,0|1,0,0]=3 262 B18R2.9194 Nc1ccc(cc1)Cc2ccc(cc2)N(C)C Amb10557688 [0,1,0,0,1,0|2,0,0]=4 263 B18R2.9194 Nc1ccc(cc1)Sc2ccc(cc2)C(C)C Amb17350400 [0,1,0,0,1,0|1,0,0]=3 264 B18R2.9194 Nc1ccc(nc1)Oc2ccc(cc2)C(C)C Amb1127804 [0,1,0,0,1,0|2,0,0]=4 265 B18R2.9194 Oc1ccc(cc1)Cc2ccc(cc2)N(C)C Amb10559716 [0,1,0,0,1,0|2,0,0]=4 266 B18R2.271 CC(=O)Nc1ccc(cc1)-c2ccc(I)cc2 Amb22478570 [0,1,0,0,1,0|1,0,1]=4 267 B18R2.271 CC(=O)Nc1ccc(cc1)c2ccc(cc2)O Amb17596247 [0,1,0,0,1,0|1,0,1]=4 268 B18R2.271 CC(C)Cc1ccc(cc1)-c2c[n]c(N)cc2 Amb23949417 [0,1,0,0,1,0|2,0,0]=4 269 B18R2.271 CC(C)Oc1ccc(cc1)-c2ccc(Br)cc2 Amb22491145 [0,1,0,0,1,0|1,0,0]=3 270 B18R2.271 CC(N)Cc1ccc(cc1)-c2ccc(Cl)cc2 Amb18935064 [0,1,0,0,1,0|2,0,0]=4 271 B18R2.271 CC(Nc1ccc(cn1)c2ccc(cc2)N)C Amb17343869 [0,1,0,0,1,0|1,0,0]=3 272 B18R2.271 CC(Oc1ccc(cc1)c2ccc(cc2)N)C Amb17142310 [0,1,0,0,1,0|1,0,0]=3 273 B18R2.271 CC(Oc1ccc(cc1)c2ccc(cc2)O)C Amb17142415 [0,1,0,0,1,0|1,0,0]=3 274 B18R2.271 CC(Oc1ccc(cc1)c2ccc(cn2)N)C Amb17248219 [0,1,0,0,1,0|2,0,0]=4 275 B18R2.271 CC(Oc1ccc(cc1)c2ccc(nc2)Cl)C Amb17259645 [0,1,0,0,1,0|2,0,0]=4 276 B18R2.271 CC(Oc1ccc(cc1)c2ccc(nc2)N)C Amb17248217 [0,1,0,0,1,0|2,0,0]=4 277 B18R2.271 CN(Cc1ccc(cc1)c2ccc(cc2)O)C Amb17136188 [0,1,0,0,1,0|2,0,0]=4 278 B18R2.271 Cc1ccc(cc1)-c2ccc(CC(C)N)cc2 Amb18271372 [0,1,0,0,1,0|2,0,0]=4 279 B18R2.2534 CC(N)C(=O)c1ccc(cc1)-c2ccccc2 Amb18070091 [0,1,0,0,1,0|2,0,0]=4 280 B18R2.2609 CC[C@H](C)Cc1ccc(cc1)-c2ccccc2 Amb24100972 [0,1,0,0,1,0|1,0,0]=3 281 B18R2.2609 CNC(C)Cc1ccc(cc1)-c2cc[n]cc2 Amb18270798 [0,1,0,0,1,0|2,0,0]=4 282 B18R2.2609 CNC(C)Cc1ccc(cc1)-c2ccccc2 Amb18270820 [0,1,0,0,1,0|1,0,0]=3 283 B18R2.2609 COC(=O)Nc1ccc(cc1)c2ccccc2 Amb2100938 [0,1,0,0,1,0|1,0,1]=4 284 B18R2.2609 ClCC(=O)Nc1ccc(cc1)c2ccccc2 Amb1208874 [0,1,0,0,1,0|1,0,1]=4 285 B18R2.2609 ClCC(Oc1ccc(cc1)c2ccccc2)C Amb17258911 [0,1,0,0,1,0|1,0,0]=3 286 B18R2.2609 OCC(Oc1ccc(cc1)c2ccccc2)C Amb17248168 [0,1,0,0,1,0|1,0,0]=3 287 B18R2.3629 CC(C)Oc1ccc(cc1N)-c2ccccc2 Amb20207129 [0,1,0,0,1,0|1,0,0]=3 288 B18R2.3629 Cc1cc(ccc1NC(C)=O)-c2ccccc2 Amb24055811 [0,1,0,0,1,0|1,0,1]=4 289 B18R2.3884 CC(N)Cc1ccc(cc1)-c2cc(Cl)ccc2 Amb18935076 [0,1,0,0,1,0|2,0,0]=4 290 B18R2.3884 CC(Nc1ccc(cn1)c2cccc(c2)N)C Amb17343871 [0,1,0,0,1,0|1,0,0]=3 291 B18R2.3884 CC(Oc1ccc(cc1)c2cccc(c2)N)C Amb17142311 [0,1,0,0,1,0|1,0,0]=3 292 B18R2.3884 CC(Oc1ccc(cc1)c2cccc(c2)O)C Amb17142416 [0,1,0,0,1,0|1,0,0]=3 293 B18R2.3884 CC(Oc1ccc(cc1)c2cncc(c2)N)C Amb17248218 [0,1,0,0,1,0|2,0,0]=4 294 B18R2.3884 CN(Cc1ccc(cc1)c2cccc(c2)O)C Amb17137483 [0,1,0,0,1,0|2,0,0]=4 295 B18R2.3884 Cc1cc(ccc1)-c2ccc(CC(C)N)cc2 Amb18935193 [0,1,0,0,1,0|2,0,0]=4 296 B18R2.4727 CC(C)Oc1ccc(cc1)-c2[n]cccc2N Amb18070392 [0,1,0,0,1,0|2,0,0]=4 297 B18R2.4727 CC(C)Oc1ccc(cc1)-c2c[n]ccc2N Amb18571898 [0,1,0,0,1,0|2,0,0]=4 298 B18R2.4727 CC(N)Cc1ccc(cc1)-c2ccccc2Cl Amb18935088 [0,1,0,0,1,0|2,0,0]=4 299 B18R2.4727 CC(N)Cc1ccc(cc1)-c2ccccc2F Amb18271351 [0,1,0,0,1,0|2,0,0]=4 300 B18R2.4727 CC(Oc1ccc(cc1)c2cccnc2Cl)C Amb17259646 [0,1,0,0,1,0|2,0,0]=4 301 B18R2.4727 CN(Cc1ccc(cc1)c2ccccc2N)C Amb17137478 [0,1,0,0,1,0|2,0,0]=4 302 B18R2.32246 CC(C)(N)Cc1ccc(cc1)-c2ccccc2 Amb18070124 [0,1,0,0,1,0|1,0,0]=3 303 B20R2.347 OCC(COc1ccc(cc1)Oc2ccccc2)C Amb17266418 [0,1,0,0,0,1|2,0,0]=4 304 B20R2.2705 CC(C(=O)Nc1ccc(cc1)Cc2ccncc2)C Amb1838593 [0,1,0,0,0,1|2,0,0]=4 305 B20R2.2705 CC(C(=O)Nc1ccc(cc1)Nc2ccccc2)C Amb11035776 [0,1,0,0,0,1|0,0,0]=2 306 B20R2.2705 CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Br Amb17333115 [0,1,0,0,0,1|2,0,0]=4 307 B20R2.2705 CC(C(=O)Nc1ccc(cc1)Oc2ccccc2)Cl Amb1204240 [0,1,0,0,0,1|2,0,0]=4 308 B20R2.2705 CN(C)C(=O)Nc1ccc(cc1)Oc2ccccc2 Amb22447303 [0,1,0,0,0,1|2,0,0]=4 309 B20R2.2705 CN(N)C(=S)Nc1ccc(cc1)Nc2ccccc2 Amb22434834 [0,1,0,0,0,1|2,0,0]=4 310 B20R2.2705 C[C@@H](N)C(=O)Nc1ccc(cc1)Oc2ccccc2 Amb18372855 [0,1,0,0,0,1|2,0,0]=4 311 B20R2.4471 CC(C)NC(=O)c1ccc(cc1)Nc2[n]ccc[n]2 Amb22012108 [0,1,0,0,0,1|2,0,0]=4 312 B20R2.4471 CC(C)OC(=O)c1ccc(Cc2ccccc2)cc1 Amb18942276 [0,1,0,0,0,1|2,0,0]=4 313 B20R2.4471 CC(C)OC(=O)c1ccc(cc1)Oc2ccccc2 Amb18276590 [0,1,0,0,0,1|2,0,0]=4 314 B20R2.8665 CC(C)CCc1ccc(cc1)Oc2ccccc2N Amb24090006 [0,1,0,0,0,1|2,0,0]=4 315 B20R2.8665 CC(COc1ccc(cc1)Nc2ncccc2N)C Amb17067626 [0,1,0,0,0,1|2,0,0]=4 316 B20R2.15796 CC(COc1ccc(cc1)Nc2ccc(cn2)N)C Amb17041136 [0,1,0,0,0,1|2,0,0]=4 317 B20R2.15796 CC(COc1ccc(cc1)Nc2ccc(nc2)N)C Amb17041229 [0,1,0,0,0,1|2,0,0]=4 318 B20R2.74032 CC(C)(C)CNc1ccc(cc1)Oc2ccccc2 Amb20076886 [0,1,0,0,0,1|1,0,0]=3 319 B20R2.8668 CC(C)Oc1ccc(CNc2cc[n]cc2Cl)cc1 Amb23708408 [0,1,0,0,0,1|2,0,0]=4 320 B20R2.8668 Cc1ccc[n]c1NCc2ccc(cc2)OC(C)C Amb23579990 [0,1,0,0,0,1|2,0,0]=4 321 B20R2.15999 CC(=O)Nc1ccc(cc1)NN=C2C=CC(=O)C=C2 Amb1200628 [0,1,0,0,0,1|1,0,1]=4 322 B20R2.15999 CC(C)Oc1ccc(CNc2ccc(Br)c[n]2)cc1 Amb23666185 [0,1,0,0,0,1|2,0,0]=4 323 B20R2.15999 CC(Nc1ccc(cc1)OCc2ccc(cc2)Cl)C Amb17307075 [0,1,0,0,0,1|1,0,0]=3 324 B20R2.17722 CC(C)Sc1ccc(cc1)C(C)Nc2cccc[n]2 Amb23626344 [0,1,0,0,0,1|2,0,0]=4 325 B20R2.17722 CC(Cc1ccc(cc1)C(=O)Nc2cccnc2)C Amb13961368 [0,1,0,0,0,1|2,0,0]=4 326 B20R2.17722 CN(C)Cc1ccc(cc1)C(=O)Nc2ccccc2 Amb22269270 [0,1,0,0,0,1|2,0,0]=4 327 B20R2.24657 CC(C(=O)c1ccc(cc1)SCc2ccccc2)C Amb17481901 [0,1,0,0,0,1|2,0,0]=4 328 B20R2.24657 CC(C)C(O)c1ccc(cc1)OCc2ccccc2 Amb22468994 [0,1,0,0,0,1|2,0,0]=4 329 B20R2.140375 CC(C)Oc1cc(F)c(cc1)NCc2c[n]ccc2 Amb24226989 [0,1,0,0,0,1|2,0,0]=4 330 B20R2.140375 CC(C)Oc1cc(F)c(cc1)NCc2cc[n]cc2 Amb24226952 [0,1,0,0,0,1|2,0,0]=4 331 B20R2.153896 CC(C)Oc1ccc(CNc2cc(Cl)[n]cc2)cc1 Amb23723170 [0,1,0,0,0,1|2,0,0]=4 332 B20R2.331093 CCC(C)Oc1ccc(CNc2ccccc2)cc1 Amb20076474 [0,1,0,0,0,1|1,0,0]=3 333 B20R2.331093 CCC(C)Oc1ccc(cc1)NCc2ccccc2 Amb20138225 [0,1,0,0,0,1|1,0,0]=3 334 B20R2.2714548 CC(C)(C)Oc1ccc(CNc2c[n]ccc2)cc1 Amb18932623 [0,1,0,0,0,1|2,0,0]=4 335 B20R2.2714548 CC(C)(C)Oc1ccc(CNc2ccccc2)cc1 Amb18269858 [0,1,0,0,0,1|1,0,0]=3 336 B20R2.2714548 CC(C)(C)Sc1c[n]c(cc1)NCc2ccccc2 Amb23446509 [0,1,0,0,0,1|2,0,0]=4 337 B20R2.10538 CC(N)(C(C)C)c1ccc(cc1)Oc2ccccc2 Amb18585486 [0,2,0,0,0,0|2,0,0]=4 338 B20R2.24665 CC(C(=O)c1ccc(cc1)N(c2ccccc2)C)C Amb17161773 [0,2,0,0,0,0|1,0,0]=3 339 B20R2.24665 CN(C)C(=O)c1ccc(cc1)N(C)c2ccccc2 Amb19557585 [0,2,0,0,0,0|2,0,0]=4 340 B20R2.392 CCOC(=O)Nc1ccc(cc1)Nc2ccccc2 Amb1948655 [0,2,0,0,0,0|1,0,1]=4 341 B20R2.392 CSCC(=O)Nc1ccc(cc1)Nc2ccccc2 Amb11279954 [0,2,0,0,0,0|1,0,1]=4 342 B20R2.392 N#CCC(=O)Nc1ccc(cc1)Nc2ccccc2 Amb17210498 [0,2,0,0,0,0|1,0,1]=4 343 B20R2.392 OCCC(Oc1ccc(cc1)Oc2ccccc2)C Amb17266417 [0,2,0,0,0,0|2,0,0]=4 344 B20R2.2807 CCC(C)Nc1ccc(cc1)Oc2ccc(O)cc2 Amb22474395 [0,2,0,0,0,0|1,0,0]=3 345 B20R2.7806 N#CC(Nc1ccc(cc1)Oc2ccccc2)(C)C Amb17413775 [0,2,0,0,0,0|1,0,0]=3 346 B20R2.4228 Cc1cc(c[n]c1NC(C)C)C(=O)c2ccccc2 Amb23578525 [0,2,0,0,0,0|2,0,0]=4 347 B20R2.4228 Cc1cc(c[n]c1NC(C)C)C(N)c2ccccc2 Amb23578532 [0,2,0,0,0,0|2,0,0]=4 348 B20R2.4228 Cc1cc(c[n]c1NC(C)C)C(O)c2ccccc2 Amb23578528 [0,2,0,0,0,0|2,0,0]=4 349 B20R2.140371 Cc1[n]c(ccc1SC(C)(C)C)Nc2ccccc2 Amb23445773 [0,2,0,0,0,0|2,0,0]=4 350 B20R2.140371 Cc1cc(Nc2ccccc2)[n]cc1SC(C)(C)C Amb23579564 [0,2,0,0,0,0|2,0,0]=4 351 B20R2.65831 Cc1[n]c(ccc1C(=O)c2ccccc2)NC(C)C Amb23445508 [0,2,0,0,0,0|2,0,0]=4 352 B20R2.65831 Cc1[n]c(ccc1C(N)c2ccccc2)NC(C)C Amb23445513 [0,2,0,0,0,0|2,0,0]=4 353 B20R2.65831 Cc1[n]c(ccc1C(O)c2ccccc2)NC(C)C Amb23579706 [0,2,0,0,0,0|2,0,0]=4 354 B20R2.65831 Cc1cc(NC(C)C)[n]cc1C(=O)c2ccccc2 Amb23579286 [0,2,0,0,0,0|2,0,0]=4 355 B20R2.65831 Cc1cc(NC(C)C)[n]cc1C(N)c2ccccc2 Amb23579301 [0,2,0,0,0,0|2,0,0]=4 356 B20R2.65831 Cc1cc(NC(C)C)[n]cc1C(O)c2ccccc2 Amb23579297 [0,2,0,0,0,0|2,0,0]=4 357 B20R2.140372 Cc1cc(c[n]c1Nc2ccccc2)SC(C)(C)C Amb23578793 [0,2,0,0,0,0|2,0,0]=4 358 B20R2.140372 Cc1cc(ccc1Nc2cc[n]cc2)OC(C)(C)C Amb18269077 [0,2,0,0,0,0|2,0,0]=4 359 B20R2.3401 CN(C)Cc1ccc(cc1)Nc2cc(ccc2)C#N Amb18268795 [0,2,0,0,0,0|2,0,0]=4 360 B20R2.3401 COc1cc(ccc1)Nc2ccc(cc2)OC(C)C Amb18930825 [0,2,0,0,0,0|1,0,0]=3 361 B20R2.4685 CC(C)Oc1ccc(cc1)Nc2cccc(Cl)c2Cl Amb18930808 [0,2,0,0,0,0|1,0,0]=3 362 B20R2.4685 Cc1c(Cl)cccc1Nc2ccc(cc2)OC(C)C Amb18930809 [0,2,0,0,0,0|1,0,0]=3 363 B20R2.4814 CC(C)Oc1ccc(cc1)Nc2cc(F)ccc2F Amb18930819 [0,2,0,0,0,0|1,0,0]=3 364 B20R2.4814 CN(C)Cc1ccc(cc1)Nc2cc(F)ccc2F Amb18931471 [0,2,0,0,0,0|2,0,0]=4 365 B20R2.4814 Cc1ccc(Cl)cc1Nc2ccc(CN(C)C)cc2 Amb18268198 [0,2,0,0,0,0|2,0,0]=4 366 B20R2.15382 CC(C)Oc1ccc(cc1)Nc2cc(C)c(C)cc2 Amb18930827 [0,2,0,0,0,0|1,0,0]=3 367 B20R2.15382 CC(C)Oc1ccc(cc1)Nc2cc(F)c(F)cc2 Amb18930817 [0,2,0,0,0,0|1,0,0]=3 368 B20R2.15382 CN(C)Cc1ccc(cc1)Nc2cc(Cl)c(F)cc2 Amb18268072 [0,2,0,0,0,0|2,0,0]=4 369 B20R2.15382 CN(C)Cc1ccc(cc1)Nc2cc(F)c(F)cc2 Amb18931546 [0,2,0,0,0,0|2,0,0]=4 370 B20R2.15382 Cc1cc(Nc2ccc(cc2)OC(C)C)[n]cc1N Amb18879479 [0,2,0,0,0,0|2,0,0]=4 371 B20R2.15382 Cc1ccc(cc1Cl)Nc2ccc(CN(C)C)cc2 Amb18268259 [0,2,0,0,0,0|2,0,0]=4 372 B20R2.153159 CC(C)Sc1ccc(cc1)C(=O)c2cc(N)ccc2 Amb18055642 [0,2,0,0,0,0|2,0,0]=4 373 B20R2.153159 CC(Cc1ccc(cc1)C(=O)c2cccc(c2)N)C Amb17263476 [0,2,0,0,0,0|2,0,0]=4 374 B20R2.153159 CC(Oc1ccc(cc1)C(=O)c2cccc(c2)N)C Amb17229435 [0,2,0,0,0,0|2,0,0]=4 375 B20R2.6637 CC(C)(C)Cc1ccc(cc1)Oc2ccccc2N Amb24093996 [0,2,0,0,0,0|2,0,0]=4 376 B20R2.6637 CC(C)(C)Oc1ccc(cc1)Nc2ccccc2Cl Amb18930692 [0,2,0,0,0,0|1,0,0]=3 377 B20R2.6637 CC(C)(C)Oc1ccc(cc1)Nc2ccccc2F Amb18930697 [0,2,0,0,0,0|1,0,0]=3 378 B20R2.8344 CC(C)Sc1ccc(cc1)C(=O)c2ccccc2N Amb18554498 [0,2,0,0,0,0|2,0,0]=4 379 B20R2.8344 CC(Cc1ccc(cc1)C(=O)c2ccccc2N)C Amb17263477 [0,2,0,0,0,0|2,0,0]=4 380 B20R2.8344 CC(Oc1ccc(cc1)C(=O)c2ccccc2N)C Amb17229437 [0,2,0,0,0,0|2,0,0]=4 381 B20R2.18909 CN(C)Cc1ccc(cc1)Nc2ccccc2OC Amb18931696 [0,2,0,0,0,0|2,0,0]=4 382 B20R2.156213 CC(=O)Nc1ccc(cc1)Nc2ccc(Cl)cc2N Amb18595410 [0,2,0,0,0,0|1,0,1]=4 383 B20R2.156213 CC(=O)Nc1ccc(cc1)Nc2ccc(N)cc2Cl Amb18595412 [0,2,0,0,0,0|1,0,1]=4 384 B20R2.156213 CC(=O)Nc1ccc(cc1)Nc2ccc(N)cc2N Amb19962357 [0,2,0,0,0,0|1,0,1]=4 385 B20R2.156213 CC(C)Oc1ccc(cc1)Nc2[n]cc(N)cc2Cl Amb18888468 [0,2,0,0,0,0|2,0,0]=4 386 B20R2.156213 CC(C)Oc1ccc(cc1)Nc2ccc(N)cc2N Amb19962435 [0,2,0,0,0,0|1,0,0]=3 387 B20R2.156213 CN(C)Cc1ccc(cc1)Nc2ccc(F)cc2F Amb18268562 [0,2,0,0,0,0|2,0,0]=4 388 B20R2.156213 Cc1cc(N)c[n]c1Nc2ccc(cc2)OC(C)C Amb18879478 [0,2,0,0,0,0|2,0,0]=4 389 B20R2.4429 CC(C)(C)Oc1ccc(cc1)Nc2ccc(Cl)cc2 Amb18930690 [0,2,0,0,0,0|1,0,0]=3 390 B20R2.15344 CC(C)Sc1ccc(cc1)C(=O)c2ccc(N)cc2 Amb18055643 [0,2,0,0,0,0|2,0,0]=4 391 B20R2.15344 CC(Cc1ccc(cc1)C(=O)c2ccc(cc2)N)C Amb17263475 [0,2,0,0,0,0|2,0,0]=4 392 B20R2.15344 CC(Oc1ccc(cc1)C(=O)c2ccc(cc2)N)C Amb17229436 [0,2,0,0,0,0|2,0,0]=4 393 B20R2.29401 CC(C)(C)Nc1ccc(c[n]1)C(=O)c2ccccc2 Amb23446821 [0,2,0,0,0,0|2,0,0]=4 394 B20R2.29401 CC(C)(C)Nc1ccc(c[n]1)C(N)c2ccccc2 Amb23446827 [0,2,0,0,0,0|2,0,0]=4 395 B20R2.29401 CC(C)(C)Nc1ccc(c[n]1)C(O)c2ccccc2 Amb23446824 [0,2,0,0,0,0|2,0,0]=4 396 B20R2.29401 CN(c1ccc(c[n]1)SC(C)(C)C)c2ccccc2 Amb23446493 [0,2,0,0,0,0|2,0,0]=4 397 B18R2.28720 CC(C)[n]1c(Cc2ccccc2)ccc1C=O Amb23154135 [0,0,1,1,0,0|2,0,0]=4 398 B18R2.6163 CC(C)NC(=O)C1=CC(=O)Nc2ccccc12 Amb20457885 [0,0,1,1,0,0|2,0,0]=4 399 B18R2.71940 CC(C)NC(=O)\C=C\c1cc2ccccc2o1 Amb20834978 [0,0,1,1,0,0|2,0,0]=4 400 B18R3.2102 C(c1ccccc1)c2ccc(cc2)C3CC3 Amb22388573 [1,0,0,1,0,0|2,0,0]=4 401 B18R3.2102 C1CC1c2ccc(cc2)Oc3ccccc3 Amb22752479 [1,0,0,1,0,0|2,0,0]=4 402 B18R3.4481 CCNc1ccc2c(c1)c3ccccc3o2 Amb1106825 [1,0,0,1,0,0|1,0,0]=3 403 B18R3.4481 NCCc1cc2c(cc1)[nH]c3ccccc23 Amb18773800 [1,0,0,1,0,0|2,0,0]=4 404 B18R3.12792 C1CNc2ccc(cc21)Nc3[n]ccc[n]3 Amb18255177 [1,0,0,1,0,0|2,0,0]=4 405 B18R3.12792 C1CNc2ccc(cc21)Nc3cccc[n]3 Amb18917534 [1,0,0,1,0,0|1,0,0]=3 406 B18R3.12792 c1c2cc[nH]c2ccc1Nc3ccccc3 Amb18269057 [1,0,0,1,0,0|0,0,2]=4 407 B18R3.12792 c1ccc(cc1)Oc2ccc3c(c2)CCN3 Amb1135972 [1,0,0,1,0,0|1,0,0]=3 408 B18R3.115616 CC(=O)c1ccc2c(c1)c3ccccc3[nH]2 Amb1196653 [0,0,0,1,1,0|1,0,1]=4 409 B18R3.115616 CC(O)c1cc2c(cc1)oc3ccccc23 Amb22453853 [0,0,0,1,1,0|2,0,0]=4 410 B18R3.151 Cc1[nH]c2ccc(cc2[n]1)-c3ccccc3 Amb23448540 [0,0,0,1,1,0|1,0,1]=4 411 B18R3.151 Cc1cc2cc(ccc2[nH]1)-c3ccccc3 Amb18244134 [0,0,0,1,1,0|0,0,2]=4 412 B18R3.151 O=C1Nc2c(C1)cc(cc2)c3ccccc3 Amb17240220 [0,0,0,1,1,0|1,0,1]=4 413 B18R3.12809 C(C1CO1)c2ccc(cc2)-c3ccccc3 Amb24080712 [0,0,0,1,1,0|2,0,0]=4 414 B20R3.14684554 CC1(C)CNc2ccc(cc12)Oc3ccccc3 Amb18899938 [0,0,0,1,0,1|1,0,0]=3 415 B20R3.30123 C(Oc1ccc(CC2CC2)cc1)c3ccccc3 Amb22752488 [0,0,0,1,0,1|2,0,0]=4 416 B20R3.30123 C(Oc1ccc(cc1)NC2CC2)c3ccccc3 Amb25377959 [0,0,0,1,0,1|1,0,0]=3 417 B20R3.2731 C(C1CNC1)c2ccc(cc2)Oc3ccccc3 Amb18577139 [0,1,0,1,0,0|2,0,0]=4 418 B20R3.2731 C1NCC1Oc2ccc(Cc3ccccc3)cc2 Amb21956445 [0,1,0,1,0,0|2,0,0]=4 419 B20R3.2731 C1OCC1Nc2ccc(cc2)Oc3ccccc3 Amb23970887 [0,1,0,1,0,0|1,0,0]=3 420 B20R3.12020 CC1Oc2ccc(cc2C1N)Oc3ccccc3 Amb23935741 [0,1,0,1,0,0|2,0,0]=4 421 B20R3.12020 Cc1c2cc(ccc2[nH]c1C)Oc3ccccc3 Amb18899779 [0,1,0,1,0,0|1,0,1]=4 422 B20R3.2789488 CN1Cc2cc(ccc2C1)Nc3cc(Cl)ccc3 Amb18268005 [0,1,0,1,0,0|2,0,0]=4 423 B20R3.2789488 CN1Cc2cc(ccc2C1)Nc3cc(F)ccc3 Amb18930994 [0,1,0,1,0,0|2,0,0]=4 424 B20R3.407802 CN1Cc2ccc(cc2C1)Nc3ccc(F)cc3 Amb18268010 [0,1,0,1,0,0|2,0,0]=4 425 B20R3.12019 CC1Nc2c(C1)cc(cc2)C(=O)c3ccccc3 Amb17121841 [0,1,0,1,0,0|1,0,0]=3 426 B20R3.34885 NC(c1ccccc1)c2c[n]c(cc2)NC3CC3 Amb23446748 [0,1,0,1,0,0|2,0,0]=4 427 B20R3.34885 O=C(c1c[n]c(cc1)NC2CC2)c3ccccc3 Amb23446742 [0,1,0,1,0,0|2,0,0]=4 428 B20R3.34885 OC(c1ccccc1)c2c[n]c(cc2)NC3CC3 Amb23446745 [0,1,0,1,0,0|2,0,0]=4 429 B20R3.3478484 CC(=O)Nc1ccc2c(c1)c3ccccc3n2C Amb2225351 [0,1,0,1,0,0|1,0,1]=4 430 B16R2.7 BrCCc1ccc(cc1)-c2ccccc2 Amb18548871 [1,0,0,0,1,0|2,0,0]=4 431 B16R2.7 CCC[n+]1ccc(cc1)-c2ccccc2 Amb22347830 [1,0,0,0,1,0|2,0,0]=4 432 B16R2.7 CCCc1c[n]c(cc1)-c2ccccc2 Amb24081239 [1,0,0,0,1,0|2,0,0]=4 433 B16R2.7 CCOc1ccc(cc1)-c2cc[n]cc2 Amb21857773 [1,0,0,0,1,0|2,0,0]=4 434 B16R2.7 CNCc1ccc(cc1)c2ccccc2 Amb1120613 [1,0,0,0,1,0|2,0,0]=4 435 B16R2.7 ClCCc1ccc(cc1)-c2ccccc2 Amb18049971 [1,0,0,0,1,0|2,0,0]=4 436 B16R2.7 ClCOc1ccc(cc1)-c2ccccc2 Amb25824948 [1,0,0,0,1,0|2,0,0]=4 437 B16R2.7 FCCc1ccc(cc1)-c2ccccc2 Amb24060269 [1,0,0,0,1,0|2,0,0]=4 438 B16R2.7 NCCc1ccc(cc1)-c2ccccc2 Amb20669578 [1,0,0,0,1,0|2,0,0]=4 439 B16R2.7 OCCc1ccc(cc1)c2ccccc2 Amb10975826 [1,0,0,0,1,0|2,0,0]=4 440 B16R2.7 SCCc1ccc(cc1)c2ccccc2 Amb17471504 [1,0,0,0,1,0|2,0,0]=4 441 B16R2.85 CC(=C)c1ccc(cc1)-c2ccccc2 Amb24078523 [0,0,0,0,2,0|0,0,2]=4 442 B16R2.85 CC(=O)c1ccc(cc1)c2ccccc2 Amb1216476 [0,0,0,0,2,0|1,0,1]=4 443 B16R2.85 CC(N)c1ccc(cc1)-c2c[n]ccc2 Amb18281669 [0,0,0,0,2,0|2,0,0]=4 444 B16R2.85 CC(N)c1ccc(cc1)-c2cc[n]cc2 Amb18966091 [0,0,0,0,2,0|2,0,0]=4 445 B16R2.85 CC(N)c1ccc(cc1)-c2cccc[n]2 Amb18935276 [0,0,0,0,2,0|2,0,0]=4 446 B16R2.85 CC(c1ccc(cc1)c2ccccc2)N Amb1215257 [0,0,0,0,2,0|1,0,0]=3 447 B16R2.85 CC(c1ccc(cc1)c2ccccc2)N Amb1995319 [0,0,0,0,2,0|1,0,0]=3 448 B16R2.85 CC(c1ccc(cc1)c2ccccc2)O Amb1792046 [0,0,0,0,2,0|1,0,0]=3 449 B16R2.85 CN(C)c1ccc(cc1)-c2cccc[n]2 Amb19928803 [0,0,0,0,2,0|2,0,0]=4 450 B16R2.85 CN(c1ccc(cc1)c2ccncc2)C Amb1021757 [0,0,0,0,2,0|2,0,0]=4 451 B16R2.85 C[C@@H](N)c1ccc(cc1)-c2ccccc2 Amb19374896 [0,0,0,0,2,0|1,0,0]=3 452 B16R2.481 CN(c1ccc(cc1)C=C2C=CC=C2)C Amb16200287 [0,0,0,0,2,0|2,0,0]=4 453 B16R2.157 CC(C)Nc1[n]c(co1)-c2ccccc2 Amb22267136 [0,0,0,0,2,0|2,0,0]=4 454 B16R2.157 CC(C)Nc1cc([nH][n]1)-c2ccccc2 Amb19002233 [0,0,0,0,2,0|2,0,0]=4 455 B16R2.157 CC(Nc1scc(n1)c2ccccc2)C Amb244389 [0,0,0,0,2,0|2,0,0]=4 456 B18R2.3840 CCNc1ccc(cc1)OCc2ccccc2 Amb17306943 [1,0,0,0,0,1|1,0,0]=3 457 B18R2.3840 CCNc1ccc(cc1)\N=N\c2ccccc2 Amb24096576 [1,0,0,0,0,1|0,0,1]=3 458 B18R2.3840 CCNc1ccc(nc1)NCc2ccccc2 Amb17318019 [1,0,0,0,0,1|1,0,0]=3 459 B18R2.3840 CCNc1ccc(nc1)NCc2ccncc2 Amb17317966 [1,0,0,0,0,1|2,0,0]=4 460 B18R2.3840 CCOc1ccc(c[n]1)NCc2ccccc2 Amb24364210 [1,0,0,0,0,1|2,0,0]=4 461 B18R2.3840 CCOc1ccc(cc1)CNc2ccccc2 Amb2542503 [1,0,0,0,0,1|1,0,0]=3 462 B18R2.3840 CCOc1ccc(cc1)CNc2ccccn2 Amb17100194 [1,0,0,0,0,1|2,0,0]=4 463 B18R2.3840 CCOc1ccc(cc1)N=Nc2ccccc2 Amb24063652 [1,0,0,0,0,1|1,0,1]=4 464 B18R2.3840 CCOc1ccc(cc1)NCc2ccccc2 Amb2508175 [1,0,0,0,0,1|1,0,0]=3 465 B18R2.3840 CCOc1ccc(cc1)NCc2cccnc2 Amb2012650 [1,0,0,0,0,1|2,0,0]=4 466 B18R2.3840 CCOc1ccc(cc1)NCc2ccncc2 Amb1926878 [1,0,0,0,0,1|2,0,0]=4 467 B18R2.3840 CCOc1ccc(cc1)OCc2ccccc2 Amb10766322 [1,0,0,0,0,1|2,0,0]=4 468 B18R2.3840 CCOc1ccc(cc1)\N=C\c2ccccc2 Amb2508174 [1,0,0,0,0,1|1,0,1]=4 469 B18R2.3840 OCCc1ccc(cc1)NCc2ccccc2 Amb25745885 [1,0,0,0,0,1|2,0,0]=4 470 B18R2.7076 CC(=O)c1ccc(cc1)NNc2ccccc2 Amb24080547 [0,0,0,0,1,1|1,0,1]=4 471 B18R2.7076 CC(C)c1ccc(CCc2cccc[n]2)cc1 Amb24080811 [0,0,0,0,1,1|2,0,0]=4 472 B18R2.7076 CC(C)c1ccc(COc2ccccc2)cc1 Amb22266097 [0,0,0,0,1,1|1,0,0]=3 473 B18R2.7076 CC(C)c1ccc(cc1)OCc2cc[n]cc2 Amb23917100 [0,0,0,0,1,1|2,0,0]=4 474 B18R2.7076 CC(C)c1ccc(cc1)OCc2ccccc2 Amb25026888 [0,0,0,0,1,1|1,0,0]=3 475 B18R2.7076 CC(N)c1c[n]c(cc1)NCc2ccccc2 Amb23446504 [0,0,0,0,1,1|2,0,0]=4 476 B18R2.7076 CC(O)c1c[n]c(cc1)NCc2ccccc2 Amb23446502 [0,0,0,0,1,1|2,0,0]=4 477 B18R2.7076 CC(O)c1ccc(cc1)SCc2ccccc2 Amb23974579 [0,0,0,0,1,1|2,0,0]=4 478 B18R2.7076 CC(c1ccc(cc1)CNc2ccccn2)C Amb1763154 [0,0,0,0,1,1|1,0,0]=3 479 B18R2.7076 CC(c1ccc(cc1)CNc2ncccn2)C Amb1846601 [0,0,0,0,1,1|2,0,0]=4 480 B18R2.7076 CC(c1ccc(cc1)OCc2ccccc2)N Amb1138339 [0,0,0,0,1,1|2,0,0]=4 481 B18R2.7076 CC(c1ccc(cc1)OCc2ccccc2)O Amb1109805 [0,0,0,0,1,1|2,0,0]=4 482 B18R2.7076 CC(c1ccc(cc1)\N=N/c2ccccn2)C Amb10559781 [0,0,0,0,1,1|1,0,1]=4 483 B18R2.7076 CN(C)c1ccc(CNc2cc[n]cc2)cc1 Amb18932736 [0,0,0,0,1,1|2,0,0]=4 484 B18R2.7076 CN(c1ccc(cc1)C#Cc2ccccc2)C Amb2227487 [0,0,0,0,1,1|2,0,0]=4 485 B18R2.7076 CN(c1ccc(cc1)CNc2ccccn2)C Amb1839684 [0,0,0,0,1,1|2,0,0]=4 486 B18R2.7076 CN(c1ccc(cc1)N=Nc2ccccc2)C Amb2390023 [0,0,0,0,1,1|1,0,1]=4 487 B18R2.7076 CN(c1ccc(cc1)OCc2ccccc2)C Amb10560805 [0,0,0,0,1,1|2,0,0]=4 488 B18R2.7076 CN(c1ccc(cc1)\N=C\c2ccccc2)C Amb1625998 [0,0,0,0,1,1|1,0,1]=4 489 B18R2.7076 C[C@@H](N)c1ccc(cc1)NCc2ccccc2 Amb24760556 [0,0,0,0,1,1|1,0,0]=3 490 B18R2.7076 C[C@@H](O)c1ccc(cc1)SCc2ccccc2 Amb23974574 [0,0,0,0,1,1|2,0,0]=4 491 B18R2.7098 CC(C)NCc1ccc(cc1)-c2c[n]cc[n]2 Amb23976456 [0,0,0,0,1,1|2,0,0]=4 492 B18R2.7098 CC(C)NCc1ccc(cc1)-c2cc[n]cc2 Amb23924742 [0,0,0,0,1,1|1,0,0]=3 493 B18R2.7098 CC(N)CCc1ccc(cc1)-c2ccccc2 Amb18227633 [0,0,0,0,1,1|2,0,0]=4 494 B18R2.7098 CC(NCc1ccc(cc1)c2ccccc2)C Amb2118688 [0,0,0,0,1,1|0,0,0]=2 495 B18R2.7098 CC(O)COc1ccc(cc1)-c2ccccc2 Amb24080098 [0,0,0,0,1,1|2,0,0]=4 496 B18R2.7098 CN(C)N=Cc1ccc(cc1)-c2ccccc2 Amb22471600 [0,0,0,0,1,1|1,0,1]=4 497 B18R2.7098 C[C@@H](N)COc1ccc(cc1)-c2ccccc2 Amb18036070 [0,0,0,0,1,1|2,0,0]=4 498 B20R2.202 CN(C)CCOc1ccc(cc1)Nc2ccccc2 Amb18931938 [0,0,0,0,0,2|2,0,0]=4 499 B20R2.10648 CC(C)COc1ccc(cc1)NCc2ccccc2 Amb19963296 [0,0,0,0,0,2|1,0,0]=3 500 B20R2.10648 CC(CNc1ccc(cc1)OCc2ccccc2)C Amb17306947 [0,0,0,0,0,2|1,0,0]=3 501 B20R2.10648 CC(COc1ccc(cc1)CNc2ccccc2)C Amb17162281 [0,0,0,0,0,2|1,0,0]=3 502 B20R2.10648 CC(NCc1ccc(cc1)OCc2ccccc2)C Amb2118463 [0,0,0,0,0,2|1,0,0]=3 503 B20R2.17714 CC(=O)Nc1ccc(cc1)CNCc2ccccc2 Amb244950 [0,0,0,0,0,2|1,0,1]=4 504 B20R2.17714 CC(=O)Nc1ccc(cc1)\C=N\Nc2ccccc2 Amb10185750 [0,0,0,0,0,2|1,0,1]=4 505 B20R2.17714 CC(C)Nc1[n]cc(CNCc2ccccc2)c[n]1 Amb23567815 [0,0,0,0,0,2|2,0,0]=4