0 B15R2.6 CC(=O)CCC1=C2C=CC=CC2=NN1 Z1638523280 [0,0,0,0,0,0|2,0,1]=3 1 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 Z276142282 [0,0,0,0,0,0|1,0,0]=1 2 B15R2.6 CN(C)CCC1=CNC2=C1N=CC=C2 Z5537309001 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.6 N=C(N)NCC1=CSC2=C1C=CC=C2 Z1090048388 [0,0,0,0,0,0|4,0,0]=4 4 B15R2.6 NC(=O)CCC1=CNC2=C1C=CC=C2 Z33546345 [0,0,0,0,0,0|1,0,0]=1 5 B15R2.6 O=C(O)/C=C/C1=CSC2=C1C=CC=C2 Z2942853122 [0,0,0,0,0,0|1,0,2]=3 6 B15R2.6 O=C(O)CCC1=CCC2=C1C=CC=C2 Z1262514880 [0,0,0,0,0,0|1,0,0]=1 7 B15R2.6 O=C(O)CCC1=CN=C2N1C=CC=C2 Z5336044044 [0,0,0,0,0,0|1,0,1]=2 8 B15R2.6 O=C(O)CCC1=CN=C2N1C=CC=N2 Z5401661850 [0,0,0,0,0,0|2,0,1]=3 9 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=C2 Z104482518 [0,0,0,0,0,0|0,0,0]=0 10 B15R2.6 O=C(O)CCC1=CSC2=C1C=CC=C2 Z995104750 [0,0,0,0,0,0|1,0,0]=1 11 B15R2.6 O=C(O)CCC1CCC2=C1C=CC=C2 Z1262511684 [0,0,0,0,0,0|1,0,2]=3 12 B15R2.6 O=C(O)CCN1C=CC2=C1C=CC=C2 Z57316204 [0,0,0,0,0,0|2,0,0]=2 13 B15R2.6 O=C(O)CCN1C=CC2=C1N=CC=C2 Z1216818692 [0,0,0,0,0,0|3,0,0]=3 14 B15R2.6 O=C(O)CCN1N=CC2=C1C=CC=C2 Z57070422 [0,0,0,0,0,0|3,0,0]=3 15 B15R2.6 O=C(O)CON1N=NC2=C1C=CC=C2 Z55928888 [0,0,0,0,0,0|3,0,1]=4 16 B15R2.6 O=C(O)CSC1=NN=C2N1C=CC=C2 Z55118889 [0,0,0,0,0,0|3,0,1]=4 17 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 Z1787158574 [1,0,0,0,0,0|2,0,1]=4 18 B14R2.3 NCCCC1=CNC2=C1C=CC=C2 Z275361382 [1,0,0,0,0,0|1,0,1]=3 19 B16R2.12 CC(CN1C=CC2=C1C=CC=C2)C(=O)O Z431542264 [0,1,0,0,0,0|2,0,0]=3 20 B16R2.12 CC(CN1C=NC2=C1C=CC=C2)C(=O)O Z420848232 [0,1,0,0,0,0|1,0,1]=3 21 B16R2.12 CC(CN1N=CC2=C1C=CC=C2)C(=O)O Z959320722 [0,1,0,0,0,0|3,0,0]=4 22 B16R2.12 CC(CN1N=NC2=C1C=CC=C2)C(=O)O Z431542322 [0,1,0,0,0,0|2,0,1]=4 23 B16R2.12 NC(CC1=CNC2=C1C=CC=C2)C(=O)O Z57248626 [0,1,0,0,0,0|0,0,0]=1 24 B16R2.12 NC(CC1=CNC2=C1C=CC=N2)C(=O)O Z1274773112 [0,1,0,0,0,0|1,0,0]=2 25 B16R2.12 NC(CC1=CNC2=C1C=NC=N2)C(=O)O Z2010009926 [0,1,0,0,0,0|2,0,0]=3 26 B16R2.12 NC(CC1=CNC2=C1N=CC=C2)C(=O)O Z2289799514 [0,1,0,0,0,0|1,0,0]=2 27 B16R2.12 NC(CC1=CNC2=C1N=CC=N2)C(=O)O Z1508941507 [0,1,0,0,0,0|2,0,0]=3 28 B16R2.12 NC(CC1=COC2=C1C=CC=C2)C(=O)O Z1416286798 [0,1,0,0,0,0|1,0,0]=2 29 B16R2.12 NC(CC1=CSC2=C1C=CC=C2)C(=O)O Z995104684 [0,1,0,0,0,0|1,0,0]=2 30 B16R2.12 NC(CN1C=CC2=C1N=CC=C2)C(=O)O Z360059800 [0,1,0,0,0,0|3,0,0]=4 31 B16R2.12 NC(CN1C=NC2=C1C=CC=C2)C(=O)O Z2289798387 [0,1,0,0,0,0|1,0,1]=3 32 B16R2.12 NC(CN1CCC2=C1C=CC=C2)C(=O)O Z4327136236 [0,1,0,0,0,0|2,0,1]=4 33 B16R2.12 N[C@@H](CC1=CNC2=C1C=CC=C2)C(=O)O Z756440056 [0,1,0,0,0,0|0,0,0]=1 34 B16R2.12 N[C@H](CC1=CNC2=C1C=CC=C2)C(=O)O Z256709618 [0,1,0,0,0,0|0,0,0]=1 35 B16R2.14 C=CC(=O)NCC1=COC2=C1C=CC=C2 Z2867516508 [0,1,0,0,0,0|3,0,0]=4 36 B16R2.14 C=CC(=O)NCC1=CSC2=C1C=CC=C2 Z2738284108 [0,1,0,0,0,0|3,0,0]=4 37 B16R2.14 CNC(=O)CCC1=CNC2=C1C=CC=C2 Z32016249 [0,1,0,0,0,0|1,0,0]=2 38 B16R2.14 COC(=O)CCC1=CNC2=C1C=CC=C2 Z13758675 [0,1,0,0,0,0|0,0,0]=1 39 B16R2.14 N/C(=N\O)/CCN1C=NC2=C1C=CC=C2 Z237599824 [0,1,0,0,0,0|2,0,1]=4 40 B16R2.520 CC(CC(=O)O)C1=CNC2=C1C=CC=C2 Z275127490 [0,1,0,0,0,0|0,0,0]=1 41 B16R2.520 CC(CC(=O)O)N1C=NC2=C1C=CC=C2 Z1695740381 [0,1,0,0,0,0|1,0,1]=3 42 B16R2.520 CC(CC(=O)O)N1CCC2=C1C=CC=C2 Z431539404 [0,1,0,0,0,0|2,0,1]=4 43 B16R2.2976 CC1=CC2=C(C=C1)C(=CN2)CCC(=O)O Z1272912333 [0,1,0,0,0,0|0,0,0]=1 44 B16R2.2976 O=C(O)CCC1=CN=C2N1C=CC(=C2)Br Z5372150272 [0,1,0,0,0,0|1,0,1]=3 45 B16R2.2976 O=C(O)CCC1=CNC2=C1C=CC(=C2)Cl Z1509536927 [0,1,0,0,0,0|0,0,0]=1 46 B16R2.4003 CC1=C(C2=C(N1)C=CC=C2)CCC(=O)O Z57157164 [0,1,0,0,0,0|0,0,0]=1 47 B16R2.4003 CC1=NC2=C(N1CCC(=O)N)C=CC=C2 Z53116498 [0,1,0,0,0,0|2,0,1]=4 48 B16R2.4003 CC1=NC2=C(N1CCC(=O)O)C=CC=C2 Z1718361743 [0,1,0,0,0,0|1,0,1]=3 49 B16R2.4003 NC(=O)N/N=C\1/C(=O)NC2=C1C=CC=C2 Z49560581 [0,1,0,0,0,0|3,0,0]=4 50 B16R2.4003 O=C(O)CCC1C(=O)NC2=C1C=CC=C2 Z1508917501 [0,1,0,0,0,0|0,0,1]=2 51 B16R2.4003 O=C(O)CCN1C(=O)OC2=C1C=CC=C2 Z57728665 [0,1,0,0,0,0|2,0,0]=3 52 B16R2.4003 O=C(O)CCN1C(=O)SC2=C1C=CC=C2 Z57728689 [0,1,0,0,0,0|2,0,0]=3 53 B16R2.15551 CC1=CC2=C(C=C1)NC=C2CCC(=O)O Z1276694079 [0,1,0,0,0,0|0,0,0]=1 54 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)Br Z4439411857 [0,1,0,0,0,0|3,0,0]=4 55 B16R2.15551 CN(C)CCC1=CNC2=C1C=C(C=C2)N Z4606621023 [0,1,0,0,0,0|3,0,0]=4 56 B16R2.15551 O=C(O)CCC1=CN=C2N1C=C(C=C2)Br Z5346930455 [0,1,0,0,0,0|1,0,1]=3 57 B16R2.15551 O=C(O)CCC1=CNC2=C1C=C(C=C2)Br Z1509618627 [0,1,0,0,0,0|0,0,0]=1 58 B16R2.15551 O=C(O)CCN1C=CC2=C1C=C(C=C2)Cl Z385445922 [0,1,0,0,0,0|2,0,0]=3 59 B16R2.22833 CC1=C2NC=C(C2=CC=C1)CCC(=O)O Z1251197519 [0,1,0,0,0,0|0,0,0]=1 60 B16R2.22833 O=C(O)CCC1=CN=C2N1C=CC=C2Br Z5405727258 [0,1,0,0,0,0|1,0,1]=3 61 B16R2.22904 CC1=C2C(=CNC2=CC=C1)CCC(=O)O Z1316679515 [0,1,0,0,0,0|0,0,0]=1 62 B16R2.22904 O=C(O)CCC1=CNC2=C1C(=CC=C2)Br Z1509573127 [0,1,0,0,0,0|0,0,0]=1 63 B16R2.104522 CC1CN(C2=C1C=CC=C2)CCC(=O)O Z1218147273 [0,1,0,0,0,0|2,0,1]=4 64 B16R2.104522 CN1C=C(C2=C1C=CC=C2)/C=C/C(=O)O Z2942853389 [0,1,0,0,0,0|0,0,2]=3 65 B16R2.104522 CN1C=C(C2=C1C=CC=C2)CCC(=O)O Z335290460 [0,1,0,0,0,0|0,0,0]=1 66 B16R2.104522 O=C(O)CCN1N=C(C2=C1C=CC=C2)O Z3301553050 [0,1,0,0,0,0|3,0,0]=4 67 B14R1.96 CCC1=C(C=CC=C1)OCCC(=O)O Z398366562 [0,0,1,0,0,0|2,0,1]=4 68 B14R1.96 COC1=C(C=CC=C1)NCCC(=O)O Z56813547 [0,0,1,0,0,0|2,0,1]=4 69 B14R1.96 COC1=C(C=CC=C1)OCCC(=O)O Z56843581 [0,0,1,0,0,0|2,0,1]=4 70 B14R1.96 O=CC1=C(C=CC=C1)OCCC(=O)O Z954894366 [0,0,1,0,0,0|3,0,0]=4 71 B14R1.160 CC1=C(C=CC=C1)C(=O)NCC(=O)O Z56983120 [0,0,1,0,0,0|3,0,0]=4 72 B14R1.160 NC1=C(C=CC=C1)C(=O)CCC(=O)O Z4561593840 [0,0,1,0,0,0|1,0,0]=2 73 B14R1.160 NC1=C(C=CC=C1)C(=O)NCC(=O)[O-] Z4994098029 [0,0,1,0,0,0|2,0,1]=4 74 B14R1.160 O=C(O)CCC(=O)C1=C(C=CC=C1)Br Z838955710 [0,0,1,0,0,0|2,0,0]=3 75 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)Br Z56945486 [0,0,1,0,0,0|3,0,0]=4 76 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)Cl Z56827160 [0,0,1,0,0,0|3,0,0]=4 77 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)F Z56822248 [0,0,1,0,0,0|3,0,0]=4 78 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)I Z85887266 [0,0,1,0,0,0|3,0,0]=4 79 B14R1.160 O=C(O)CNC(=O)C1=C(C=CC=C1)O Z3478749045 [0,0,1,0,0,0|3,0,0]=4 80 B14R1.422 O=C(O)CCCCCC1=CC=CC=C1 Z424791194 [0,0,1,0,0,0|1,0,2]=4 81 B14R1.422 O=C(O)CCCNCC1=CC=CC=C1 Z1569708913 [0,0,1,0,0,0|2,0,1]=4 82 B14R1.422 O=C(O)CCCOCC1=CC=CC=C1 Z316258810 [0,0,1,0,0,0|2,0,1]=4 83 B14R1.422 O=C(O)CCNCCC1=CC=CC=C1 Z1270173016 [0,0,1,0,0,0|2,0,1]=4 84 B14R1.422 O=C(O)COC/C=C/C1=CC=CC=C1 Z2887852692 [0,0,1,0,0,0|2,0,1]=4 85 B16R3.426 O=C(O)C1CC12CCC3=C2C=CC=C3 Z979743412 [0,0,0,1,0,0|1,0,2]=4 86 B16R3.2637 OC1=CC2=C(C=C1)C3=C(N2)C=CC=C3 Z56347314 [0,0,0,1,0,0|1,0,2]=4 87 B14R2.2 CC(=O)CC1=CNC2=C1C=CC=C2 Z277541166 [0,0,0,0,1,0|1,0,0]=2 88 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 Z199464144 [0,0,0,0,1,0|2,0,0]=3 89 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 Z56917380 [0,0,0,0,1,0|3,0,0]=4 90 B14R2.2 NC(=O)CC1=CNC2=C1C=CC=C2 Z33546521 [0,0,0,0,1,0|1,0,0]=2 91 B14R2.2 NC(=O)CC1=NOC2=C1C=CC=C2 Z101186134 [0,0,0,0,1,0|3,0,0]=4 92 B14R2.2 NC(=O)CC1=NSC2=C1C=CC=C2 Z1198158706 [0,0,0,0,1,0|3,0,0]=4 93 B14R2.2 NC(=O)CN1C=NC2=C1C=CC=C2 Z19648288 [0,0,0,0,1,0|2,0,1]=4 94 B14R2.2 O=C(O)CC1=CN=C2N1C=CC=N2 Z4579553371 [0,0,0,0,1,0|2,0,1]=4 95 B14R2.2 O=C(O)CC1=CN=C2N1N=CC=C2 Z4511427996 [0,0,0,0,1,0|2,0,1]=4 96 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 Z56913182 [0,0,0,0,1,0|0,0,0]=1 97 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=N2 Z978942538 [0,0,0,0,1,0|1,0,0]=2 98 B14R2.2 O=C(O)CC1=CNC2=C1C=CN=C2 Z2213893334 [0,0,0,0,1,0|1,0,0]=2 99 B14R2.2 O=C(O)CC1=COC2=C1C=CC=C2 Z119989454 [0,0,0,0,1,0|1,0,0]=2 100 B14R2.2 O=C(O)CC1=CSC2=C1C=CC=C2 Z432090858 [0,0,0,0,1,0|1,0,0]=2 101 B14R2.2 O=C(O)CC1=NNC2=C1C=CC=C2 Z335442472 [0,0,0,0,1,0|1,0,0]=2 102 B14R2.2 O=C(O)CC1=NOC2=C1C=CC=C2 Z99600464 [0,0,0,0,1,0|2,0,0]=3 103 B14R2.2 O=C(O)CC1=NSC2=C1C=CC=C2 Z1262511380 [0,0,0,0,1,0|2,0,0]=3 104 B14R2.2 O=C(O)CC1CCC2=C1C=CC=C2 Z352782144 [0,0,0,0,1,0|1,0,2]=4 105 B14R2.2 O=C(O)CC1CNC2=C1C=CC=C2 Z1259339975 [0,0,0,0,1,0|0,0,2]=3 106 B14R2.2 O=C(O)CC1COC2=C1C=CC=C2 Z1198234596 [0,0,0,0,1,0|1,0,2]=4 107 B14R2.2 O=C(O)CN1C=CC2=C1C=CC=C2 Z274525914 [0,0,0,0,1,0|2,0,0]=3 108 B14R2.2 O=C(O)CN1C=NC2=C1C=CC=C2 Z237574652 [0,0,0,0,1,0|1,0,1]=3 109 B14R2.2 O=C(O)CN1N=CC2=C1C=CC=C2 Z959320648 [0,0,0,0,1,0|3,0,0]=4 110 B14R2.2 O=C(O)CN1N=NC2=C1C=CC=C2 Z57069978 [0,0,0,0,1,0|2,0,1]=4 111 B16R2.36 CC(=O)NCCC1=CNC2=C1C=CC=C2 Z26395416 [0,0,0,0,0,1|1,0,0]=2 112 B16R2.36 N=C(N)NCCC1=CNC2=C1C=CC=C2 Z1089997728 [0,0,0,0,0,1|2,0,0]=3 113 B16R2.36 O=C(O)CCCC1=CNC2=C1C=CC=C2 Z56754864 [0,0,0,0,0,1|0,0,0]=1 114 B16R2.36 O=C(O)CCCC1=CSC2=C1C=CC=C2 Z370714626 [0,0,0,0,0,1|1,0,0]=2 115 B16R2.36 O=C(O)CCCC1=NNC2=C1C=CC=C2 Z1509682641 [0,0,0,0,0,1|1,0,0]=2 116 B16R2.36 O=C(O)CCCN1C=NC2=C1C=CC=C2 Z285049656 [0,0,0,0,0,1|1,0,1]=3 117 B16R2.477 NC(=O)COC1=CC2=C(C=CC=C2)C=C1 Z19834621 [0,0,0,0,0,1|3,0,0]=4 118 B16R2.477 NC(=O)CSC1=NC2=C(C=CC=C2)C=C1 Z19647382 [0,0,0,0,0,1|3,0,0]=4 119 B16R2.477 NC(=O)CSC1=NC2=C(C=CC=C2)N=C1 Z33546141 [0,0,0,0,0,1|2,0,1]=4 120 B16R2.477 O=C(O)/C=C/C1=CC2=C(C=CC=C2)C=C1 Z2942853570 [0,0,0,0,0,1|1,0,2]=4 121 B16R2.477 O=C(O)/C=C/C1=NC2=C(C=CC=C2)C=C1 Z2737710986 [0,0,0,0,0,1|1,0,2]=4 122 B16R2.477 O=C(O)/C=C/C1=NC2=C(C=CC=C2)N=C1 Z56943517 [0,0,0,0,0,1|0,0,3]=4 123 B16R2.477 O=C(O)C/N=C\1/CCC2=C(N1)C=CC=C2 Z425449558 [0,0,0,0,0,1|2,0,1]=4 124 B16R2.477 O=C(O)CCC1=CC2=C(C=CC=C2)C=C1 Z317037912 [0,0,0,0,0,1|1,0,0]=2 125 B16R2.477 O=C(O)CCC1=CC2=C(C=CC=C2)N=C1 Z1272682544 [0,0,0,0,0,1|0,0,1]=2 126 B16R2.477 O=C(O)CCN1CCC2=C(C1)C=CC=C2 Z1459955990 [0,0,0,0,0,1|2,0,1]=4 127 B16R2.477 O=C(O)COC1=CC2=C(C=CC=C2)C=C1 Z57246951 [0,0,0,0,0,1|2,0,0]=3 128 B16R2.477 O=C(O)CSC1=CC2=C(C=CC=C2)C=C1 Z56755986 [0,0,0,0,0,1|2,0,0]=3 129 B16R2.477 O=C(O)CSC1=NC2=C(C=CC=C2)N=C1 Z57040471 [0,0,0,0,0,1|1,0,1]=3 130 B16R2.179941 CC(=O)CCC1=C2C=CC=CC2=CN=C1 Z1233207880 [0,0,0,0,0,1|1,0,1]=3 131 B16R2.179941 CC(=O)COC1=C2C=CC=CC2=NC=N1 Z18537666 [0,0,0,0,0,1|2,0,1]=4 132 B16R2.179941 NC(=O)CNC1=C2C=CC=CC2=CC=C1 Z104644698 [0,0,0,0,0,1|3,0,0]=4 133 B16R2.179941 NC(=O)CNC1=C2C=CC=CC2=NC=N1 Z127860128 [0,0,0,0,0,1|2,0,1]=4 134 B16R2.179941 NC(=O)COC1=C2C=CC=CC2=CC=C1 Z19769010 [0,0,0,0,0,1|3,0,0]=4 135 B16R2.179941 NC(=O)CSC1=C2C=CC=CC2=NC=N1 Z19316000 [0,0,0,0,0,1|2,0,1]=4 136 B16R2.179941 O=C(O)/C=C/C1=C2C=CC=CC2=CC=C1 Z2311958211 [0,0,0,0,0,1|1,0,2]=4 137 B16R2.179941 O=C(O)/C=C/C1=C2C=CC=CC2=CN=C1 Z1172376379 [0,0,0,0,0,1|0,0,3]=4 138 B16R2.179941 O=C(O)/C=C/C1=C2C=CC=CC2=NC=C1 Z1165164552 [0,0,0,0,0,1|0,0,3]=4 139 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CC=C1 Z317037922 [0,0,0,0,0,1|1,0,0]=2 140 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=CN=C1 Z1272682681 [0,0,0,0,0,1|0,0,1]=2 141 B16R2.179941 O=C(O)CCC1=C2C=CC=CC2=NC=C1 Z1165164633 [0,0,0,0,0,1|0,0,1]=2 142 B16R2.179941 O=C(O)CCC1=C2C=CN=CC2=CC=C1 Z3301406443 [0,0,0,0,0,1|2,0,0]=3 143 B16R2.179941 O=C(O)CCN1CCCC2=C1C=CC=C2 Z57069967 [0,0,0,0,0,1|2,0,1]=4 144 B16R2.179941 O=C(O)CNC1=C2C=CC=CC2=NC=N1 Z57000603 [0,0,0,0,0,1|1,0,1]=3 145 B16R2.179941 O=C(O)COC1=C2C=CC=CC2=CC=C1 Z56900768 [0,0,0,0,0,1|2,0,0]=3 146 B16R2.179941 O=C(O)COC1=C2C=CC=CC2=NC=N1 Z111781332 [0,0,0,0,0,1|1,0,1]=3 147 B16R2.179941 O=C(O)COC1=C2N=CC=CC2=CC=C1 Z1665253539 [0,0,0,0,0,1|3,0,0]=4 148 B16R2.179941 O=C(O)CSC1=C2C=CC=CC2=CC=N1 Z276158602 [0,0,0,0,0,1|2,0,0]=3 149 B16R2.179941 O=C(O)CSC1=C2C=CC=CC2=NC=N1 Z56754267 [0,0,0,0,0,1|1,0,1]=3 150 B13R1.158 CC1=C(C=CC=C1)NCCC(=O)O Z56922066 [1,0,1,0,0,0|1,0,1]=4 151 B13R1.158 CC1=C(C=CC=C1)OCCC(=O)O Z56805748 [1,0,1,0,0,0|1,0,1]=4 152 B13R1.158 NC(=O)CCOC1=C(C=CC=C1)N Z382711142 [1,0,1,0,0,0|2,0,0]=4 153 B13R1.158 NC(=O)CCSC1=C(C=CC=C1)N Z382712128 [1,0,1,0,0,0|2,0,0]=4 154 B13R1.158 NC1=C(C=CC=C1)CCCC(=O)O Z1982493918 [1,0,1,0,0,0|0,0,1]=3 155 B13R1.158 O=C(O)C/C=C/C1=C(C=CC=C1)F Z1354602491 [1,0,1,0,0,0|1,0,1]=4 156 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)Br Z1097106913 [1,0,1,0,0,0|1,0,1]=4 157 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)Cl Z1209411177 [1,0,1,0,0,0|1,0,1]=4 158 B13R1.158 O=C(O)CCCC1=C(C=CC=C1)F Z1198171601 [1,0,1,0,0,0|1,0,1]=4 159 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)Br Z295439184 [1,0,1,0,0,0|2,0,0]=4 160 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)Cl Z206905212 [1,0,1,0,0,0|2,0,0]=4 161 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)F Z56922157 [1,0,1,0,0,0|2,0,0]=4 162 B13R1.158 O=C(O)CCOC1=C(C=CC=C1)O Z1262518325 [1,0,1,0,0,0|2,0,0]=4 163 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)Br Z293002250 [1,0,1,0,0,0|2,0,0]=4 164 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)Cl Z56813499 [1,0,1,0,0,0|2,0,0]=4 165 B13R1.158 O=C(O)CCSC1=C(C=CC=C1)F Z103229718 [1,0,1,0,0,0|2,0,0]=4 166 B13R1.45 CC(CCC(=O)O)C1=CC=CC=C1 Z1198150373 [1,0,1,0,0,0|0,0,2]=4 167 B13R1.45 CN(CCC(=O)O)C1=CC=CC=C1 Z1259273310 [1,0,1,0,0,0|1,0,1]=4 168 B13R1.45 NC(CCC(=O)O)C1=CC=CC=C1 Z2213893322 [1,0,1,0,0,0|0,0,1]=3 169 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 Z57127328 [1,0,1,0,0,0|1,0,0]=3 170 B13R1.45 O=C(O)CCC(=O)C1=CC=NC=C1 Z1255488500 [1,0,1,0,0,0|2,0,0]=4 171 B13R1.45 O=C(O)CCC(=O)C1=CN=CC=C1 Z838955798 [1,0,1,0,0,0|2,0,0]=4 172 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 Z56771024 [1,0,1,0,0,0|2,0,0]=4 173 B13R2.1 N#CCC1=CNC2=C1C=CC=C2 Z104477894 [2,0,0,0,0,0|1,0,1]=4 174 B13R2.1 NCCC1=CNC2=C1C=CC=C2 Z104478080 [2,0,0,0,0,0|1,0,0]=3 175 B13R2.1 NCCC1=CNC2=C1C=CC=N2 Z3013846178 [2,0,0,0,0,0|2,0,0]=4 176 B13R2.1 NCCC1=CNC2=C1C=CN=C2 Z2685925193 [2,0,0,0,0,0|2,0,0]=4 177 B13R2.1 NCCC1=CNC2=C1N=CC=C2 Z1741982367 [2,0,0,0,0,0|2,0,0]=4 178 B13R2.1 NCCC1=CSC2=C1C=CC=C2 Z432090862 [2,0,0,0,0,0|2,0,0]=4 179 B13R2.1 OCCC1=CNC2=C1C=CC=C2 Z1123806416 [2,0,0,0,0,0|0,0,0]=2 180 B15R1.5793 CC(CC(=O)C1=C(C=CC=C1)F)C(=O)O Z838957192 [0,1,1,0,0,0|2,0,0]=4 181 B15R1.5822 O=C(O)CCC(=O)C1=C(C=C(C=C1)F)F Z285137144 [0,1,1,0,0,0|2,0,0]=4 182 B15R1.8312 O=C(O)CCC(=O)C1=C(C=CC=C1F)F Z838955656 [0,1,1,0,0,0|2,0,0]=4 183 B15R1.8420 CC1=CC(=C(C=C1)C)C(=O)CCC(=O)O Z56886447 [0,1,1,0,0,0|2,0,0]=4 184 B15R1.8420 O=C(O)CCC(=O)C1=C(C=CC(=C1)Cl)Cl Z389933216 [0,1,1,0,0,0|2,0,0]=4 185 B15R1.8420 O=C(O)CCC(=O)C1=C(C=CC(=C1)F)F Z285137126 [0,1,1,0,0,0|2,0,0]=4 186 B15R1.1081 NC(=O)CCNC(=O)NC1=CC=CC=C1 Z33545690 [0,1,1,0,0,0|2,0,0]=4 187 B15R1.1081 O=C(O)CCCC(=O)NC1=CC=NC=C1 Z275154544 [0,1,1,0,0,0|1,0,1]=4 188 B15R1.1081 O=C(O)CCNC(=O)CC1=CC=CC=C1 Z85914383 [0,1,1,0,0,0|2,0,0]=4 189 B15R1.1081 O=C(O)CCNC(=O)NC1=CC=CC=C1 Z56760697 [0,1,1,0,0,0|1,0,0]=3 190 B15R1.5919 O=C(O)CNC(=O)/C=C/C1=CC=CC=C1 Z56883153 [0,1,1,0,0,0|2,0,0]=4 191 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 Z1069312128 [1,1,0,0,0,0|0,0,1]=3 192 B15R2.4 O=C(CC1=CNC2=C1C=CC=C2)NO Z59181979 [1,1,0,0,0,0|1,0,1]=4 193 B15R2.5 NCCCCC1=CNC2=C1C=CC=C2 Z3766503508 [1,1,0,0,0,0|1,0,1]=4 194 B15R2.73 CC(CCO)C1=CNC2=C1C=CC=C2 Z1262570410 [1,1,0,0,0,0|0,0,1]=3 195 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCC=O Z2750451565 [1,1,0,0,0,0|0,0,0]=2 196 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CC(=O)O Z940713560 [0,1,0,0,1,0|0,0,0]=2 197 B15R2.377 CC1=CC2=C(C=C1)C(=CO2)CC(=O)O Z56776913 [0,1,0,0,1,0|1,0,0]=3 198 B15R2.377 NC(=O)CC1=CNC2=C1C=CC(=C2)F Z997948672 [0,1,0,0,1,0|1,0,0]=3 199 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Br Z978942580 [0,1,0,0,1,0|0,0,0]=2 200 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Cl Z940713564 [0,1,0,0,1,0|0,0,0]=2 201 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)F Z927291412 [0,1,0,0,1,0|0,0,0]=2 202 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)Cl Z1269129100 [0,1,0,0,1,0|1,0,0]=3 203 B15R2.377 O=C(O)CC1=COC2=C1C=CC(=C2)O Z56983130 [0,1,0,0,1,0|1,0,0]=3 204 B15R2.377 O=C(O)CC1=CSC2=C1C=CC(=C2)Br Z2733638462 [0,1,0,0,1,0|1,0,0]=3 205 B15R2.377 O=C(O)CC1=CSC2=C1C=CC(=C2)Cl Z2733267599 [0,1,0,0,1,0|1,0,0]=3 206 B15R2.377 O=C(O)CC1=NOC2=C1C=CC(=C2)F Z1255451112 [0,1,0,0,1,0|2,0,0]=4 207 B15R2.377 O=C(O)CN1C=CC2=C1C=CC(=C2)Br Z382706468 [0,1,0,0,1,0|2,0,0]=4 208 B15R2.377 O=C(O)CN1C=CC2=C1C=CC(=C2)F Z1160903217 [0,1,0,0,1,0|2,0,0]=4 209 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)N Z339563896 [0,1,0,0,1,0|1,0,0]=3 210 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)O Z335447192 [0,1,0,0,1,0|0,0,0]=2 211 B15R2.993 CC1=C(C2=C(O1)C=CC=C2)CC(=O)O Z1262521044 [0,1,0,0,1,0|1,0,0]=3 212 B15R2.993 CC1=CC2=C(N1CC(=O)O)C=CC=C2 Z104341874 [0,1,0,0,1,0|2,0,0]=4 213 B15R2.993 CC1=NC2=C(N1CC(=O)O)C=CC=C2 Z56812811 [0,1,0,0,1,0|1,0,1]=4 214 B15R2.993 O=C(O)/C=C\1/C(=O)NC2=C1C=CC=C2 Z56827367 [0,1,0,0,1,0|0,0,1]=3 215 B15R2.993 O=C(O)CC1=C(SC2=C1C=CC=C2)Br Z3681807548 [0,1,0,0,1,0|1,0,0]=3 216 B15R2.993 O=C(O)CC1C(=O)NC2=C1C=CC=C2 Z336080924 [0,1,0,0,1,0|0,0,1]=3 217 B15R2.993 O=C(O)CN1C(=O)CC2=C1C=CC=C2 Z234897271 [0,1,0,0,1,0|2,0,0]=4 218 B15R2.993 O=C(O)CN1C(=O)NC2=C1C=CC=C2 Z431996746 [0,1,0,0,1,0|1,0,0]=3 219 B15R2.993 O=C(O)CN1C(=O)OC2=C1C=CC=C2 Z56974908 [0,1,0,0,1,0|2,0,0]=4 220 B15R2.993 O=C(O)CN1C(=S)SC2=C1C=CC=C2 Z57213501 [0,1,0,0,1,0|2,0,0]=4 221 B15R2.1255 CC(C(=O)O)N1C=NC2=C1C=CC=C2 Z57841909 [0,1,0,0,1,0|1,0,1]=4 222 B15R2.1255 O=C(O)C(=O)C1=CNC2=C1C=CC=C2 Z381360918 [0,1,0,0,1,0|0,0,1]=3 223 B15R2.9410 CC1=CC2=C(C=C1)N=CN2CC(=O)O Z1945984220 [0,1,0,0,1,0|1,0,1]=4 224 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(=O)O Z1138836786 [0,1,0,0,1,0|0,0,0]=2 225 B15R2.9410 CC1=CC2=C(C=C1)OC=C2CC(=O)O Z57906221 [0,1,0,0,1,0|1,0,0]=3 226 B15R2.9410 O=C(O)CC1=C2C=C(C=CC2=NS1)Br Z2733644395 [0,1,0,0,1,0|1,0,1]=4 227 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(C=C2)Cl Z1162450206 [0,1,0,0,1,0|0,0,0]=2 228 B15R2.9410 O=C(O)CC1=CSC2=C1C=C(C=C2)Br Z1434712888 [0,1,0,0,1,0|1,0,0]=3 229 B15R2.9410 O=C(O)CC1=CSC2=C1C=C(C=C2)Cl Z1269130758 [0,1,0,0,1,0|1,0,0]=3 230 B15R2.9410 O=C(O)CC1=NOC2=C1C=C(C=C2)Br Z1269167493 [0,1,0,0,1,0|2,0,0]=4 231 B15R2.9410 O=C(O)CC1=NOC2=C1C=C(C=C2)F Z1262525596 [0,1,0,0,1,0|2,0,0]=4 232 B15R2.9410 O=C(O)CN1C=CC2=C1C=C(C=C2)Br Z916009482 [0,1,0,0,1,0|2,0,0]=4 233 B15R2.9410 O=C(O)CN1C=CC2=C1C=C(C=C2)Cl Z385445930 [0,1,0,0,1,0|2,0,0]=4 234 B15R2.13587 CC1=C2NC=C(C2=CC=C1)CC(=O)O Z1198148795 [0,1,0,0,1,0|0,0,0]=2 235 B15R2.13587 NC(=O)CC1=CNC2=C1C=CC=C2Br Z1269130594 [0,1,0,0,1,0|1,0,0]=3 236 B15R2.13587 NC1=C2C=CN(C2=CC=C1)CC(=O)O Z3067530366 [0,1,0,0,1,0|2,0,0]=4 237 B15R2.13587 O=C(O)CC1=CNC2=C1C=CC=C2Br Z1269161790 [0,1,0,0,1,0|0,0,0]=2 238 B15R2.13587 O=C(O)CC1=CNC2=C1C=CC=C2F Z1198266463 [0,1,0,0,1,0|0,0,0]=2 239 B15R2.13587 O=C(O)CC1=CSC2=C1C=CC=C2Br Z1434712885 [0,1,0,0,1,0|1,0,0]=3 240 B15R2.13587 O=C(O)CC1=CSC2=C1C=CC=C2Cl Z1434712863 [0,1,0,0,1,0|1,0,0]=3 241 B15R2.13587 O=C(O)CC1=CSC2=C1C=CC=C2F Z1434712871 [0,1,0,0,1,0|1,0,0]=3 242 B15R2.13587 O=C(O)CN1C=CC2=C1C=CC=C2Cl Z1269231707 [0,1,0,0,1,0|2,0,0]=4 243 B15R2.13624 CC1=C2C(=CNC2=CC=C1)CC(=O)O Z978942564 [0,1,0,0,1,0|0,0,0]=2 244 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Br Z1269131875 [0,1,0,0,1,0|0,0,0]=2 245 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Cl Z1269128767 [0,1,0,0,1,0|0,0,0]=2 246 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=N2)Cl Z2856150067 [0,1,0,0,1,0|1,0,0]=3 247 B15R2.13624 O=C(O)CC1=CSC2=C1C(=CC=C2)Cl Z2733267584 [0,1,0,0,1,0|1,0,0]=3 248 B15R2.13624 O=C(O)CC1=CSC2=C1C(=CC=C2)F Z2732947823 [0,1,0,0,1,0|1,0,0]=3 249 B15R2.53147 CC1=CN(C2=C1C=CC=C2)CC(=O)O Z415654038 [0,1,0,0,1,0|2,0,0]=4 250 B15R2.53147 CN1N=C(C2=C1C=CC=C2)CC(=O)O Z1268483039 [0,1,0,0,1,0|1,0,0]=3 251 B17R2.4 CCC(=O)NCCC1=CNC2=C1C=CC=C2 Z26395465 [0,1,0,0,0,1|1,0,0]=3 252 B17R2.4 CN/C(=N/CCC1=CNC2=C1C=CC=C2)/N Z1127393610 [0,1,0,0,0,1|2,0,0]=4 253 B17R2.4 CNC(=O)NCCC1=CSC2=C1C=CC=C2 Z513560640 [0,1,0,0,0,1|2,0,0]=4 254 B17R2.4 CNC(=S)NCCC1=CNC2=C1C=CC=C2 Z45830904 [0,1,0,0,0,1|1,1,0]=4 255 B17R2.4 COC(=O)NCCN1C=NC2=C1C=CC=C2 Z934800016 [0,1,0,0,0,1|1,0,1]=4 256 B17R2.4 NCC(=O)NCCC1=CNC2=C1C=CC=C2 Z1449765636 [0,1,0,0,0,1|1,0,0]=3 257 B17R2.4 O=C(CCl)NCCC1=CNC2=C1C=CC=C2 Z57396119 [0,1,0,0,0,1|1,0,0]=3 258 B17R2.16 NC(CCC1=CNC2=C1C=CC=C2)C(=O)O Z3681285360 [0,1,0,0,0,1|0,0,0]=2 259 B17R2.877 O=C(O)CCC(=O)C1=CSC2=C1C=CC=C2 Z370714370 [0,1,0,0,0,1|1,0,0]=3 260 B17R2.5025 O=C(O)CCCN1C(=O)OC2=C1C=CC=C2 Z56974917 [0,1,0,0,0,1|2,0,0]=4 261 B17R2.25462 CC(=O)NCCC1=CNC2=C1C=C(C=C2)F Z1220452176 [0,1,0,0,0,1|1,0,0]=3 262 B17R2.37553 NC(=NCCC1=CNC2=C1C(=CC=C2)Br)N Z2518791892 [0,1,0,0,0,1|2,0,0]=4 263 B17R2.556 CNC(=O)CCC1=CC2=C(C=CC=C2)C=C1 Z729102816 [0,1,0,0,0,1|2,0,0]=4 264 B17R2.5006 CC1=C(C=C2C=CC=NC2=N1)CCC(=O)O Z2044766676 [0,1,0,0,0,1|1,0,1]=4 265 B17R2.5006 O=C(O)/C=C/C1=CC2=C(C=CC=C2)NC1=O Z3219847314 [0,1,0,0,0,1|0,0,2]=4 266 B17R2.5006 O=C(O)CCC1=CC2=C(C=CC=C2)NC1=O Z1508914306 [0,1,0,0,0,1|0,0,0]=2 267 B17R2.5006 O=C(O)CCC1=NC2=C(C=CC=C2)NC1=O Z56862720 [0,1,0,0,0,1|0,0,0]=2 268 B17R2.5006 O=C(O)CCC1=NC2=C(C=CC=C2)OC1=O Z57042007 [0,1,0,0,0,1|1,0,0]=3 269 B17R2.9167 C[C@H](OC1=CC2=C(C=CC=C2)C=C1)C(=O)O Z1508918419 [0,1,0,0,0,1|2,0,0]=4 270 B17R2.9167 C[C@H](OC1=CC2=C(C=CC=C2)N=C1)C(=O)O Z1924120523 [0,1,0,0,0,1|1,0,1]=4 271 B17R2.9167 NC(CC1=CC2=C(C=CC=C2)N=C1)C(=O)O Z3083125006 [0,1,0,0,0,1|0,0,1]=3 272 B17R2.9167 N[C@@H](CC1=CC2=C(C=CC=C2)C=C1)C(=O)O Z2695741431 [0,1,0,0,0,1|1,0,0]=3 273 B17R2.9167 O=C(O)C(=O)CC1=CC2=C(C=CC=C2)C=C1 Z271004474 [0,1,0,0,0,1|1,0,1]=4 274 B17R2.9167 O=C(O)C(O)CC1=CC2=C(C=C1)N=CC=C2 Z3742606306 [0,1,0,0,0,1|2,0,0]=4 275 B17R2.18967 NC(CC(=O)O)C1=CC2=C(C=CC=C2)C=C1 Z317027278 [0,1,0,0,0,1|1,0,0]=3 276 B17R2.19759 O=C(O)COC1=CC2=C(C=C1)C=C(C=C2)Br Z65585408 [0,1,0,0,0,1|2,0,0]=4 277 B17R2.40403 CC1=C2C=CC=CC2=NC(=C1)SCC(=O)O Z31205889 [0,1,0,0,0,1|2,0,0]=4 278 B17R2.40403 O=C(O)CCC1=NC2=C(C=CC=C2)C(=O)N1 Z56869288 [0,1,0,0,0,1|2,0,0]=4 279 B17R2.155580 O=C(O)CCN1C=NC2=C(C1=O)C=CC=C2 Z168879920 [0,1,0,0,0,1|1,0,1]=4 280 B17R2.155580 O=C(O)COC1=C(C2=C(C=CC=C2)C=C1)Br Z57202805 [0,1,0,0,0,1|2,0,0]=4 281 B17R2.155580 O=C(O)CSC1=C(C2=C(C=CC=C2)C=C1)Br Z56775414 [0,1,0,0,0,1|2,0,0]=4 282 B17R2.5014 CC(=O)NCC1=CC(=O)NC2=C1C=CC=C2 Z1268273655 [0,1,0,0,0,1|2,0,0]=4 283 B17R2.5385 O=C(O)CCN1C(=O)CCC2=C1C=CC=C2 Z271097324 [0,1,0,0,0,1|2,0,0]=4 284 B17R2.5385 O=C(O)CCN1C(=O)COC2=C1C=CC=C2 Z90121780 [0,1,0,0,0,1|2,0,0]=4 285 B17R2.5385 O=C(O)CCN1C(=O)CSC2=C1C=CC=C2 Z94598708 [0,1,0,0,0,1|2,0,0]=4 286 B17R2.39629 O=C(O)CCC1=C2C=CC=CC2=C(C=C1)F Z2696918879 [0,1,0,0,0,1|1,0,0]=3 287 B17R2.39629 O=C(O)CCN1N=CC(=O)C2=C1C=CC=C2 Z135257368 [0,1,0,0,0,1|2,0,0]=4 288 B17R2.39629 O=C(O)COC1=C2C=CC=CC2=C(C=C1)Cl Z65583844 [0,1,0,0,0,1|2,0,0]=4 289 B17R2.252033 O=C(O)CSC1=C2C(=CC=CC2=CC=C1)Cl Z56779305 [0,1,0,0,0,1|2,0,0]=4 290 B17R2.353364 COC(=O)CNC1=C2C=CC=CC2=CC=C1 Z297576282 [0,1,0,0,0,1|2,0,0]=4 291 B17R2.353364 COC(=O)CSC1=C2C=CC=CC2=NC=N1 Z19316006 [0,1,0,0,0,1|1,0,1]=4 292 B17R2.520754 CC(CC1=C2C=CC=CC2=CN=C1)C(=O)O Z2096659213 [0,1,0,0,0,1|0,0,1]=3 293 B17R2.520754 CC(OC1=C2C=CC=CC2=CC=C1)C(=O)O Z111834290 [0,1,0,0,0,1|2,0,0]=4 294 B17R2.520754 NC(CC1=C2C=CC=CC2=CC=N1)C(=O)O Z5620690588 [0,1,0,0,0,1|1,0,0]=3 295 B17R2.520754 N[C@@H](CC1=C2C=CC=CC2=CC=C1)C(=O)O Z995228046 [0,1,0,0,0,1|1,0,0]=3 296 B17R2.520754 O=C(O)C(O)CC1=C2C=CC=CC2=CC=C1 Z1269030425 [0,1,0,0,0,1|1,0,0]=3 297 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=C2 Z56921839 [0,2,0,0,0,0|0,0,0]=2 298 B17R2.7 COC(=O)C(N)CC1=CNC2=C1C=CC=N2 Z4918299399 [0,2,0,0,0,0|1,0,0]=3 299 B17R2.7 COC(=O)C(N)CC1=COC2=C1C=CC=C2 Z2786042022 [0,2,0,0,0,0|1,0,0]=3 300 B17R2.7 COC(=O)[C@H](N)CC1=CNC2=C1C=CC=C2 Z1536943518 [0,2,0,0,0,0|0,0,0]=2 301 B17R2.2473 O=S(=O)([O-])C(O)CC1=CNC2=C1C=CC=C2 Z1970017019 [0,2,0,0,0,0|1,0,1]=4 302 B17R2.3450 NC(CC1=CNC2=C1C=CC(=C2)F)C(=O)O Z1332305266 [0,2,0,0,0,0|0,0,0]=2 303 B17R2.5003 CC1=NC2=C(N1CC(C)C(=O)O)C=CC=C2 Z228590082 [0,2,0,0,0,0|1,0,1]=4 304 B17R2.5003 N[C@@H](CC1C(=O)NC2=C1C=CC=C2)C(=O)O Z4154843098 [0,2,0,0,0,0|0,0,1]=3 305 B17R2.25461 NC(CC1=CNC2=C1C=C(C=C2)Br)C(=O)O Z1255605966 [0,2,0,0,0,0|0,0,0]=2 306 B17R2.25461 N[C@@H](CC1=CNC2=C1C=C(C=C2)O)C(=O)O Z2044741046 [0,2,0,0,0,0|0,0,0]=2 307 B17R2.37147 CC1=C2NC=C(C2=CC=C1)CC(N)C(=O)O Z1508920449 [0,2,0,0,0,0|0,0,0]=2 308 B17R2.37147 CC1=C2OC=C(C2=CC=C1)CC(N)C(=O)O Z3717373756 [0,2,0,0,0,0|1,0,0]=3 309 B17R2.37552 NC(CC1=CNC2=C1C(=CC=C2)Br)C(=O)O Z1508591890 [0,2,0,0,0,0|0,0,0]=2 310 B17R2.6 CCNC(=O)CCC1=CNC2=C1C=CC=C2 Z32024281 [0,2,0,0,0,0|1,0,0]=3 311 B17R2.6 CONC(=O)CCC1=CNC2=C1C=CC=C2 Z245507102 [0,2,0,0,0,0|0,0,0]=2 312 B17R2.61029 COC(=O)N/N=C\1/C(=O)NC2=C1C=CC=C2 Z49622011 [0,2,0,0,0,0|2,0,0]=4 313 B17R2.87547 C=CC(=O)NCC1=CN(C2=C1C=CC=C2)C Z3405280283 [0,2,0,0,0,0|2,0,0]=4 314 B17R2.87547 COC(=O)CCC1=CN(C2=C1C=CC=C2)C Z1397148112 [0,2,0,0,0,0|0,0,0]=2 315 B17R2.376041 CNC(=O)CCC1=CNC2=C1C(=CC=C2)C Z1319159086 [0,2,0,0,0,0|1,0,0]=3 316 B17R2.853 CC(=O)CC(C)(C)C1=CNC2=C1C=CC=C2 Z1509143524 [0,2,0,0,0,0|1,0,0]=3 317 B17R2.2764 COC1=CC2=C(C=C1)C(=CN2)CCC(=O)O Z3241301171 [0,2,0,0,0,0|0,0,0]=2 318 B17R2.20780 O=C(O)CCN1C(=O)OC2=C1C=CC(=C2)Cl Z99599882 [0,2,0,0,0,0|2,0,0]=4 319 B17R2.39006 O=C(O)CCN1C=NC2=C1C=C(C(=C2)F)F Z287342854 [0,2,0,0,0,0|1,0,1]=4 320 B17R2.1273 CCC1=NC2=C(N1CCC(=O)O)C=CC=C2 Z53111423 [0,2,0,0,0,0|1,0,1]=4 321 B17R2.150937 CC1=CC2=C(C=C1)OC(=O)N2CCC(=O)O Z111781436 [0,2,0,0,0,0|2,0,0]=4 322 B17R2.464799 CC1=C(N(C2=C1C=CC=C2)CCC(=O)O)C Z432066732 [0,2,0,0,0,0|2,0,0]=4 323 B17R2.464799 CN1C(=O)N(C2=C1C=CC=C2)CCC(=O)O Z220639078 [0,2,0,0,0,0|1,0,0]=3 324 B17R2.140478 O=CC1=CN(C2=C1C=CC=C2)CCC(=O)O Z1508928468 [0,2,0,0,0,0|2,0,0]=4 325 B15R2.1668 O=C(O)CC1=CC2=C(C=CC=C2)C=C1 Z56754861 [0,0,1,1,0,0|1,0,1]=4 326 B15R2.1668 O=C(O)CC1=CC2=C(C=CC=C2)N=C1 Z982129790 [0,0,1,1,0,0|0,0,2]=4 327 B15R2.1668 O=C(O)CC1CNC2=C(S1)C=CC=C2 Z368412990 [0,0,1,1,0,0|1,0,1]=4 328 B15R2.14951 C[C@@H]1C[C@@H](NC2=C1C=CC=C2)C(=O)O Z4354673941 [0,0,1,1,0,0|0,0,2]=4 329 B15R2.14951 O=C1CC(CC2=C1C=CC=C2)C(=O)O Z1198159601 [0,0,1,1,0,0|2,0,0]=4 330 B15R2.63 O=C(O)C1CCCN1C2=CC=CC=C2 Z1416174150 [0,0,1,1,0,0|0,0,2]=4 331 B15R2.68122 O=C(O)CC1=C2C=CC=CC2=CC=C1 Z57169437 [0,0,1,1,0,0|1,0,1]=4 332 B15R2.68122 O=C(O)CC1CCNC2=C1C=CC=C2 Z3071178982 [0,0,1,1,0,0|0,0,2]=4 333 B15R2.59 O=C(O)C1CC(=NO1)C2=CC=CC=C2 Z367679464 [0,0,1,1,0,0|2,0,0]=4 334 B15R2.1660 O=C(O)CCC1=CC2=C(O1)C=CC=C2 Z137628830 [0,0,1,1,0,0|2,0,0]=4 335 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)NC=C2 Z1198310844 [0,0,1,1,0,0|2,0,0]=4 336 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 Z1526503389 [1,0,0,1,0,0|2,0,0]=4 337 B15R3.2009 O=C1CC2=C(C1)C3=C(N2)C=CC=C3 Z1255384489 [0,0,0,1,1,0|1,0,0]=3 338 B17R3.26 O=C1CC(CN1)C2=CNC3=C2C=CC=C3 Z1509155775 [0,0,0,1,0,1|1,0,0]=3 339 B17R3.52847 O=C(O)C1CC12C(=O)NC3=C2C=CC=C3 Z1508969555 [0,1,0,1,0,0|0,0,1]=3 340 B13R1.90 COC1=C(C=CC=C1)CCC(=O)O Z56943761 [0,0,1,0,1,0|1,0,1]=4 341 B13R1.90 N#CC1=C(C=CC=C1)CCC(=O)O Z227834792 [0,0,1,0,1,0|2,0,0]=4 342 B13R1.90 NCC1=C(C=CC=C1)CCC(=O)O Z3282061068 [0,0,1,0,1,0|2,0,0]=4 343 B13R1.337 CC(=O)OC/C=C/C1=CC=CC=C1 Z19628284 [0,0,1,0,1,0|2,0,0]=4 344 B13R1.337 O=C(O)CC/C=C/C1=CC=CC=C1 Z1222331031 [0,0,1,0,1,0|0,0,0]=2 345 B13R1.337 O=C(O)CCC#CC1=CC=CC=C1 Z1262510757 [0,0,1,0,1,0|0,0,2]=4 346 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 Z361415662 [0,0,1,0,1,0|0,0,2]=4 347 B13R1.337 O=C(O)CCCNC1=CC=CC=C1 Z445129480 [0,0,1,0,1,0|0,0,1]=3 348 B13R1.337 O=C(O)CCCOC1=CC=CC=C1 Z104496174 [0,0,1,0,1,0|1,0,1]=4 349 B13R1.337 O=C(O)CCCSC1=CC=CC=C1 Z56862233 [0,0,1,0,1,0|1,0,1]=4 350 B13R1.337 O=C(O)CCNCC1=CC=CC=C1 Z335451288 [0,0,1,0,1,0|1,0,1]=4 351 B13R1.337 O=C(O)CCOCC1=CC=CC=C1 Z316258802 [0,0,1,0,1,0|1,0,1]=4 352 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 Z54671437 [0,0,1,0,1,0|1,0,1]=4 353 B13R1.713 C=CC(CC(=O)O)C1=CC=CC=C1 Z1262511239 [0,0,1,0,1,0|1,0,1]=4 354 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 Z1255487817 [0,0,1,0,1,0|0,0,2]=4 355 B13R2.72 CC(=O)C1=CNC2=C1C=CC=N2 Z361892222 [0,0,0,0,2,0|2,0,0]=4 356 B13R2.72 CC(=O)C1=COC2=C1C=CC=C2 Z1066258200 [0,0,0,0,2,0|2,0,0]=4 357 B13R2.72 CC(=O)C1=CSC2=C1C=CC=C2 Z370714364 [0,0,0,0,2,0|2,0,0]=4 358 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 Z1198176576 [0,0,0,0,2,0|2,0,0]=4 359 B13R2.72 N=C(N)C1=CNC2=C1C=CC=C2 Z3300708685 [0,0,0,0,2,0|2,0,0]=4 360 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 Z87615024 [0,0,0,0,2,0|1,0,0]=3 361 B13R2.72 O=C(O)C1=C2C=CC=CC2=NO1 Z1201621664 [0,0,0,0,2,0|1,0,1]=4 362 B13R2.72 O=C(O)C1=C2C=CC=CC2=NS1 Z1198233085 [0,0,0,0,2,0|1,0,1]=4 363 B13R2.72 O=C(O)C1=C2C=CC=CN2N=C1 Z1143452918 [0,0,0,0,2,0|1,0,1]=4 364 B13R2.72 O=C(O)C1=CN=C2N1C=CC=C2 Z1201621330 [0,0,0,0,2,0|1,0,1]=4 365 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 Z89283908 [0,0,0,0,2,0|0,0,0]=2 366 B13R2.72 O=C(O)C1=CNC2=C1C=CC=N2 Z385370186 [0,0,0,0,2,0|1,0,0]=3 367 B13R2.72 O=C(O)C1=CNC2=C1C=NC=C2 Z4185705011 [0,0,0,0,2,0|1,0,0]=3 368 B13R2.72 O=C(O)C1=CNC2=C1C=NC=N2 Z1255460317 [0,0,0,0,2,0|2,0,0]=4 369 B13R2.72 O=C(O)C1=CNC2=C1N=CC=C2 Z1945708062 [0,0,0,0,2,0|1,0,0]=3 370 B13R2.72 O=C(O)C1=COC2=C1C=CC=C2 Z897816312 [0,0,0,0,2,0|1,0,0]=3 371 B13R2.72 O=C(O)C1=CSC2=C1C=CC=C2 Z199507040 [0,0,0,0,2,0|1,0,0]=3 372 B13R2.72 O=C(O)C1=CSC2=C1C=CN=C2 Z4925961941 [0,0,0,0,2,0|2,0,0]=4 373 B13R2.72 O=C(O)C1=CSC2=C1C=NC=C2 Z4010561587 [0,0,0,0,2,0|2,0,0]=4 374 B13R2.72 O=C(O)C1=CSC2=C1N=CC=C2 Z1486016114 [0,0,0,0,2,0|2,0,0]=4 375 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 Z104497388 [0,0,0,0,2,0|1,0,0]=3 376 B13R2.72 O=C(O)C1=NNC2=C1C=CC=N2 Z1198305721 [0,0,0,0,2,0|2,0,0]=4 377 B13R2.72 O=C(O)C1=NSC2=C1C=CC=C2 Z1198157386 [0,0,0,0,2,0|2,0,0]=4 378 B15R1.256 O=C(O)CCC(=O)NC1=C(C=CC=C1)Cl Z56176911 [0,0,1,0,0,1|2,0,0]=4 379 B15R1.256 O=C(O)CCC(=O)NC1=C(C=CC=C1)O Z57125020 [0,0,1,0,0,1|2,0,0]=4 380 B15R1.8019 CC1=C(C=CC=C1)C(=O)NCCC(=O)O Z85914440 [0,0,1,0,0,1|2,0,0]=4 381 B15R1.8019 NC(=O)CCNC(=O)C1=C(C=CC=C1)N Z431594646 [0,0,1,0,0,1|2,0,0]=4 382 B15R1.8019 NC1=C(C=CC=C1)C(=O)CCCC(=O)O Z4657799880 [0,0,1,0,0,1|1,0,0]=3 383 B15R1.8019 O=C(O)CCNC(=O)C1=C(C=CC=C1)Cl Z56821823 [0,0,1,0,0,1|2,0,0]=4 384 B15R1.8019 O=C(O)CCNC(=O)C1=C(C=CC=C1)F Z85914939 [0,0,1,0,0,1|2,0,0]=4 385 B15R2.352 O=CCCC1=CC2=C(C=CC=C2)N=C1 Z1233208003 [1,0,0,0,0,1|0,0,1]=3 386 B15R2.352 OCCCC1=NC2=C(C=CC=C2)C=C1 Z1198265860 [1,0,0,0,0,1|1,0,1]=4 387 B15R2.18471 OCCCC1=C2C=CC=CC2=CC=C1 Z993012474 [1,0,0,0,0,1|1,0,1]=4 388 B17R2.5669 CC(=O)NCCC1=CC2=C(C=CC=C2)C=C1 Z384256698 [0,0,0,0,0,2|2,0,0]=4 389 B17R2.5669 O=C(O)CCCC1=NC2=C(C=CC=N2)C=C1 Z4898404245 [0,0,0,0,0,2|2,0,0]=4 390 B17R2.5669 O=C(O)CCOC1=CC2=C(C=CC=C2)C=C1 Z240085208 [0,0,0,0,0,2|1,0,0]=3 391 B17R2.291558 NC(=O)CCNC1=C2C=CC=CC2=NC=N1 Z600501624 [0,0,0,0,0,2|1,0,1]=4 392 B17R2.291558 NC(=O)CCSC1=C2C=CC=CC2=NC=N1 Z102937348 [0,0,0,0,0,2|1,0,1]=4 393 B17R2.291558 O=C(O)CCOC1=C2C=CC=CC2=CC=C1 Z240085196 [0,0,0,0,0,2|1,0,0]=3