0 B13R1.417 C/N=C(\NC)/NCC1=CC=CC=C1 Z1089994842 [0,0,0,0,0,0|0,0,0]=0 1 B12R1.27 C#CC(=O)NCC1=CC=CC=C1 Z1509142729 [1,0,0,0,0,0|2,0,1]=4 2 B12R1.27 C/N=C(\N)/NCC1=CN=CC=C1 Z1090000620 [1,0,0,0,0,0|1,0,0]=2 3 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 Z56757233 [1,0,0,0,0,0|2,0,1]=4 4 B12R1.27 CCC(C)NCC1=CC=CC=C1 Z57981002 [1,0,0,0,0,0|1,0,1]=3 5 B12R1.27 CCC(N)CCC1=CC=CC=C1 Z406453862 [1,0,0,0,0,0|2,0,1]=4 6 B12R1.27 CN(CCC1=CC=CC=C1)N=O Z3965372830 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.27 CNC(=O)CCC1=CC=CC=C1 Z32016418 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.27 CNC(=O)COC1=CC=CC=C1 Z19735428 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.27 CNC(=O)CSC1=CC=CC=C1 Z19750829 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.27 CNC(=O)NCC1=NN=CC=C1 Z1881574487 [1,0,0,0,0,0|3,0,0]=4 11 B12R1.27 CNC(=O)OCC1=CC=CC=C1 Z32016983 [1,0,0,0,0,0|2,0,0]=3 12 B12R1.27 COC(=O)CCC1=CC=CC=C1 Z18264384 [1,0,0,0,0,0|3,0,0]=4 13 B12R1.27 COC(=O)NNC1=CC=CC=C1 Z56755853 [1,0,0,0,0,0|3,0,0]=4 14 B12R1.27 C[C@H](CO)NCC1=CC=CC=C1 Z823499606 [1,0,0,0,0,0|2,0,1]=4 15 B12R1.27 N/C(=N\O)/CCC1=CC=CC=C1 Z285132818 [1,0,0,0,0,0|2,0,0]=3 16 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 Z104341168 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.27 NCC(=O)NCC1=CC=CC=C1 Z398557160 [1,0,0,0,0,0|3,0,0]=4 18 B12R1.27 NNC(=S)NCC1=CC=CC=C1 Z56828396 [1,0,0,0,0,0|2,0,0]=3 19 B12R1.27 NNC(=S)NCC1=CN=CC=C1 Z56887673 [1,0,0,0,0,0|3,0,0]=4 20 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 Z56896328 [1,0,0,0,0,0|3,0,0]=4 21 B12R1.27 O=C(CO)NCC1=CC=CC=C1 Z228585446 [1,0,0,0,0,0|3,0,0]=4 22 B14R1.58 C/N=C(\NC)/NC(C)C1=CC=CC=C1 Z1089996262 [0,1,0,0,0,0|0,0,0]=1 23 B14R1.387 C/N=C(\NC)/NCC1=C(C=CC=C1)Cl Z1089995236 [0,1,0,0,0,0|0,0,0]=1 24 B14R1.529 C/N=C(\NC)/NCC1=CC=C(C=C1)Br Z1146864677 [0,1,0,0,0,0|0,0,0]=1 25 B14R1.529 C/N=C(\NC)/NCC1=CC=C(C=C1)C Z911465434 [0,1,0,0,0,0|0,0,0]=1 26 B14R2.8 CNC1=NC=C(S1)C2=CC=CC=C2 Z1037583260 [0,0,0,1,0,0|1,0,2]=4 27 B14R2.8 CNC1=NN=C(O1)C2=CC=CC=C2 Z1509142797 [0,0,0,1,0,0|2,0,1]=4 28 B14R2.8 CNC1=NN=C(S1)C2=CC=CC=C2 Z1274177422 [0,0,0,1,0,0|2,0,1]=4 29 B14R2.8 CNC1=NNC(=C1)C2=CC=CC=C2 Z1021411592 [0,0,0,1,0,0|2,0,1]=4 30 B14R2.8 CSC1=NN=C(N1)C2=CC=CC=C2 Z25398987 [0,0,0,1,0,0|2,0,1]=4 31 B14R2.101 C1=CC(=CN=C1)C/N=C\2/CCCN2 Z55927776 [0,0,0,1,0,0|2,0,1]=4 32 B14R2.101 C1=CC(=CN=C1)CNC2=NCCS2 Z367661262 [0,0,0,1,0,0|2,0,0]=3 33 B14R2.101 C1=CC=C(C=C1)CCC2=NN=NN2 Z335295262 [0,0,0,1,0,0|3,0,0]=4 34 B14R2.101 C1=CC=C(C=C1)CCC2CCCN2 Z281773822 [0,0,0,1,0,0|2,0,1]=4 35 B14R2.101 C1=CC=C(C=C1)CNC2=NC=CS2 Z86229412 [0,0,0,1,0,0|1,0,2]=4 36 B14R2.101 C1=CC=C(C=C1)CNC2=NC=NS2 Z1259046780 [0,0,0,1,0,0|2,0,1]=4 37 B14R2.101 C1=CC=C(C=C1)CNC2=NCCN2 Z1089994872 [0,0,0,1,0,0|0,0,0]=1 38 B14R2.101 C1=CC=C(C=C1)CNC2=NCCS2 Z56858227 [0,0,0,1,0,0|1,0,0]=2 39 B14R2.101 C1=CC=C(C=C1)CNC2CCCC2 Z90661352 [0,0,0,1,0,0|2,0,1]=4 40 B14R2.101 C1=CC=C(C=C1)CSC2=NCCN2 Z89241755 [0,0,0,1,0,0|1,0,0]=2 41 B14R2.101 C1=CN=C(C=C1)NNC2=NCCC2 Z56765826 [0,0,0,1,0,0|3,0,0]=4 42 B12R1.118 CCC(CC1=CC=CC=C1)NC Z513799420 [0,0,0,0,1,0|1,0,1]=3 43 B12R1.118 CCN(CC1=CC=CC=C1)N=O Z1198158367 [0,0,0,0,1,0|3,0,0]=4 44 B14R1.546 COC(CNCC1=CC=CC=C1)OC Z86134485 [0,0,0,0,0,1|2,0,1]=4 45 B11R1.28 CCCNCC1=CC=CC=C1 Z56946091 [2,0,0,0,0,0|1,0,1]=4 46 B11R1.28 CNCCCC1=CC=CC=C1 Z102767020 [2,0,0,0,0,0|1,0,1]=4 47 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [2,0,0,0,0,0|1,0,0]=3 48 B11R1.91 CC(=O)NCC1=NC=CC=C1 Z324553036 [2,0,0,0,0,0|2,0,0]=4 49 B11R1.91 CC(=O)NNC1=CC=CC=C1 Z27767717 [2,0,0,0,0,0|2,0,0]=4 50 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [2,0,0,0,0,0|2,0,0]=4 51 B11R1.91 CC(C)NCC1=CN=CC=C1 Z90502194 [2,0,0,0,0,0|1,0,1]=4 52 B11R1.91 CC(C)NCC1=NC=CC=C1 Z90502192 [2,0,0,0,0,0|1,0,1]=4 53 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [2,0,0,0,0,0|1,0,1]=4 54 B11R1.91 CN(C)CCC1=CC=CC=C1 Z168912026 [2,0,0,0,0,0|2,0,0]=4 55 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [2,0,0,0,0,0|1,0,1]=4 56 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [2,0,0,0,0,0|1,0,0]=3 57 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [2,0,0,0,0,0|2,0,0]=4 58 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [2,0,0,0,0,0|2,0,0]=4 59 B11R1.91 N=C(N)NCC1=CC=NC=C1 Z2723680409 [2,0,0,0,0,0|1,0,0]=3 60 B11R1.91 N=C(N)NCC1=NC=CC=C1 Z911465258 [2,0,0,0,0,0|1,0,0]=3 61 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [2,0,0,0,0,0|1,0,0]=3 62 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [2,0,0,0,0,0|2,0,0]=4 63 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [2,0,0,0,0,0|1,0,0]=3 64 B11R1.91 NC(=O)NCC1=CC=NC=C1 Z198194796 [2,0,0,0,0,0|2,0,0]=4 65 B11R1.91 NC(=O)NCC1=CN=CC=C1 Z57664442 [2,0,0,0,0,0|2,0,0]=4 66 B11R1.91 NC(=O)NCC1=NC=CC=C1 Z198194794 [2,0,0,0,0,0|2,0,0]=4 67 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [2,0,0,0,0,0|2,0,0]=4 68 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [2,0,0,0,0,0|2,0,0]=4 69 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [2,0,0,0,0,0|1,0,0]=3 70 B11R1.91 NC(=S)NNC1=CC=CC=C1 Z104483868 [2,0,0,0,0,0|2,0,0]=4 71 B13R1.11 CCC(=O)NC(C)C1=CC=CC=C1 Z31450130 [1,1,0,0,0,0|2,0,0]=4 72 B13R1.11 CNC(=N)NC(C)C1=CC=CC=C1 Z1347691728 [1,1,0,0,0,0|0,0,0]=2 73 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)Br Z1336804093 [1,1,0,0,0,0|2,0,0]=4 74 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)C Z192611328 [1,1,0,0,0,0|2,0,0]=4 75 B13R1.14 CNC(=O)CCC1=CC=C(C=C1)F Z135505342 [1,1,0,0,0,0|2,0,0]=4 76 B13R1.14 CNC(C)CCC1=CC=C(C=C1)O Z3215375352 [1,1,0,0,0,0|1,0,1]=4 77 B13R1.14 NNC(=S)NCC1=CC=C(C=C1)F Z111411728 [1,1,0,0,0,0|2,0,0]=4 78 B13R1.15 C/N=C(\N)/NCC1=CC(=CC=C1)Br Z1090034392 [1,1,0,0,0,0|0,0,0]=2 79 B13R1.15 CNC(=O)NCC1=NC=CC(=C1)N Z2863952887 [1,1,0,0,0,0|2,0,0]=4 80 B13R1.15 COC(=O)NCC1=CC(=CC=C1)O Z728883650 [1,1,0,0,0,0|2,0,0]=4 81 B13R1.42 C/C=C/C(=O)NCC1=CC=CC=C1 Z27749594 [1,1,0,0,0,0|2,0,0]=4 82 B13R1.42 CC(CCO)NCC1=CC=CC=C1 Z1241678662 [1,1,0,0,0,0|1,0,1]=4 83 B13R1.42 CCNC(=O)NCC1=CC=CC=C1 Z44585735 [1,1,0,0,0,0|1,0,0]=3 84 B13R1.42 CCNC(=O)OCC1=CC=CC=C1 Z32025015 [1,1,0,0,0,0|2,0,0]=4 85 B13R1.42 CCOC(=O)NCC1=CC=CC=C1 Z31478129 [1,1,0,0,0,0|2,0,0]=4 86 B13R1.42 CNCC(=O)NCC1=CC=CC=C1 Z46191183 [1,1,0,0,0,0|1,0,0]=3 87 B13R1.42 COCC(=O)NCC1=CC=CC=C1 Z31478538 [1,1,0,0,0,0|2,0,0]=4 88 B13R1.42 CONC(=O)CCC1=CC=CC=C1 Z254325116 [1,1,0,0,0,0|2,0,0]=4 89 B13R1.42 CSCC(=O)NCC1=CC=CC=C1 Z27748784 [1,1,0,0,0,0|2,0,0]=4 90 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 Z285214492 [1,1,0,0,0,0|2,0,0]=4 91 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 Z1449756300 [1,1,0,0,0,0|2,0,0]=4 92 B13R1.135 CNC(=O)N(C)CC1=CC=CC=C1 Z177087670 [1,1,0,0,0,0|1,0,0]=3 93 B13R1.351 CC(Cl)C(=O)NCC1=CC=CC=C1 Z56914802 [1,1,0,0,0,0|2,0,0]=4 94 B13R1.351 CC(N)C(=O)NCC1=CC=CC=C1 Z234893901 [1,1,0,0,0,0|2,0,0]=4 95 B13R1.351 CC(O)C(=O)NCC1=CC=CC=C1 Z798740028 [1,1,0,0,0,0|2,0,0]=4 96 B13R1.351 CN(C)C(=O)NCC1=CN=CC=C1 Z166703568 [1,1,0,0,0,0|2,0,0]=4 97 B13R1.351 CN(C)C(=O)OCC1=CC=CC=C1 Z32014975 [1,1,0,0,0,0|2,0,0]=4 98 B13R1.351 CN(C)C(=S)NCC1=CC=CC=C1 Z45810672 [1,1,0,0,0,0|1,0,0]=3 99 B13R1.351 CN(N)C(=S)NCC1=CC=CC=C1 Z56851283 [1,1,0,0,0,0|1,0,0]=3 100 B13R1.528 CCC(=O)NCC1=C(C=CC=C1)C Z52337400 [1,1,0,0,0,0|2,0,0]=4 101 B13R1.528 CCC(=O)NCC1=C(C=CC=C1)F Z29857782 [1,1,0,0,0,0|2,0,0]=4 102 B13R1.528 CNC(=O)CCC1=C(C=CC=C1)Br Z605596238 [1,1,0,0,0,0|2,0,0]=4 103 B13R1.528 CNC(=O)CCC1=C(C=CC=C1)Cl Z32015398 [1,1,0,0,0,0|2,0,0]=4 104 B13R1.528 CNC(=O)CCC1=C(C=CC=C1)O Z242124126 [1,1,0,0,0,0|2,0,0]=4 105 B13R1.528 CNC(=S)NNC1=C(C=CC=C1)Cl Z45820194 [1,1,0,0,0,0|2,0,0]=4 106 B13R1.79 CCNC(CC)CC1=CC=CC=C1 Z513799512 [0,1,0,0,1,0|1,0,1]=4 107 B13R1.79 CNC(COC)CC1=CC=CC=C1 Z1836338813 [0,1,0,0,1,0|1,0,1]=4 108 B13R1.145 CCC(CC1=CC=C(C=C1)C)NC Z513804920 [0,1,0,0,1,0|1,0,1]=4 109 B13R1.316 C/N=C(\NC)/NCC1=CC=NN1C Z1089986588 [0,1,0,0,1,0|2,0,0]=4 110 B13R1.416 C/N=C(\NC)/NCC1=CSC(=N1)C Z911465728 [0,1,0,0,1,0|2,0,0]=4 111 B15R1.9 C/N=C(\NC)/NCCC1=CC=C(C=C1)O Z991163702 [0,1,0,0,0,1|0,0,0]=2 112 B15R1.667 C/N=C(\NC)/NCCC1=CC(=CC=C1)C Z1090051960 [0,1,0,0,0,1|0,0,0]=2 113 B15R1.5710 C/N=C(\NC)/NCCC1=C(C=CC=C1)Cl Z1090031776 [0,1,0,0,0,1|0,0,0]=2 114 B15R1.167 CC/N=C(\NC)/NCC1=C(C=CC=C1)C Z1210759892 [0,2,0,0,0,0|0,0,0]=2 115 B15R1.462 C/N=C(\NC)/NCC1=C(C=C(C=C1)C)C Z1090027016 [0,2,0,0,0,0|0,0,0]=2 116 B15R1.462 C/N=C(\NC)/NCC1=C(C=C(C=C1)F)F Z1090035336 [0,2,0,0,0,0|0,0,0]=2 117 B15R1.462 CNC(=NCC1=C(C=C(C=C1)Cl)Cl)NC Z1127394048 [0,2,0,0,0,0|0,0,2]=4 118 B15R1.4479 C/N=C(\NC)/N(C)CC1=C(C=CC=C1)Br Z1202108285 [0,2,0,0,0,0|0,0,0]=2 119 B15R1.30116 C/N=C(\NC)/NCC1=C(C=CC=C1F)F Z1425732089 [0,2,0,0,0,0|0,0,0]=2 120 B15R1.207 C/N=C(\NC)/NCC1=CC=C(C=C1)OC Z911465400 [0,2,0,0,0,0|0,0,0]=2 121 B15R1.1625 C/N=C(\NC)/NCC1=CC(=CC=C1)OC Z1089999146 [0,2,0,0,0,0|0,0,0]=2 122 B15R1.9945 CNC(=NCC1=CC(=CC(=C1)F)Br)NC Z1127542153 [0,2,0,0,0,0|0,0,2]=4 123 B15R1.5336 C/N=C(/NCC1=CC=CC=C1)\NC(C)C Z1198194005 [0,2,0,0,0,0|0,0,0]=2 124 B15R1.5336 C/N=C(/NCC1=NC=CC=C1)\NC(C)C Z1198223437 [0,2,0,0,0,0|1,0,0]=3 125 B13R2.10 CC1CC(CN1)C2=CC=CC=C2 Z1203620755 [1,0,0,1,0,0|1,0,1]=4 126 B13R2.10 NC1=NC(CO1)C2=CC=CC=C2 Z1262629910 [1,0,0,1,0,0|1,0,1]=4 127 B13R2.10 NC1=NC=C(N1)C2=CC=CC=C2 Z1198173209 [1,0,0,1,0,0|0,0,2]=4 128 B13R2.10 NC1=NCC(N1)C2=CC=CC=C2 Z4461628926 [1,0,0,1,0,0|0,0,0]=2 129 B13R2.10 O=C1CC(CN1)C2=CC=CC=C2 Z954601980 [1,0,0,1,0,0|2,0,0]=4 130 B13R2.10 O=C1NC(CO1)C2=CC=CC=C2 Z57199626 [1,0,0,1,0,0|2,0,0]=4 131 B13R2.10 O=C1NCC(N1)C2=CC=CC=C2 Z1255433877 [1,0,0,1,0,0|1,0,0]=3 132 B13R2.33 O=C1CCC2=C(C=CC=C2)CN1 Z1198153747 [1,0,0,1,0,0|2,0,0]=4 133 B13R2.52 CNC1CC(C1)C2=CC=CC=C2 Z444333842 [1,0,0,1,0,0|1,0,1]=4 134 B13R2.57 CCC1CC2=C(C=CC=C2)CN1 Z979717460 [1,0,0,1,0,0|1,0,1]=4 135 B13R2.57 CNC1=NC2=C(C=CC=C2)C=C1 Z54984227 [1,0,0,1,0,0|1,0,1]=4 136 B13R2.57 CNC1=NC2=C(C=CC=C2)N=C1 Z728939702 [1,0,0,1,0,0|2,0,0]=4 137 B13R2.57 CNC1CCC2=C(C1)C=CC=C2 Z102767748 [1,0,0,1,0,0|1,0,1]=4 138 B13R2.57 NCC1=NC2=C(C=CC=C2)CN1 Z1250132657 [1,0,0,1,0,0|2,0,0]=4 139 B13R2.57 ONC1=NC2=C(C=CC=C2)CC1 Z1255495184 [1,0,0,1,0,0|2,0,0]=4 140 B13R2.373 CC1C(=O)NC1C2=CC=CC=C2 Z1267861070 [1,0,0,1,0,0|2,0,0]=4 141 B13R2.2383 C1=CC=C(C=C1)CNC2CCC2 Z3013892395 [1,0,0,1,0,0|1,0,1]=4 142 B13R2.45 CNC1=NC2=C(N1C)C=CC=C2 Z1198162309 [0,0,0,1,1,0|0,0,2]=4 143 B13R2.45 CN\1C2=C(C=CC=C2)S/C1=N/N Z271004716 [0,0,0,1,1,0|2,0,0]=4 144 B13R2.45 CSC1=NC2=C(N1C)C=CC=C2 Z15478802 [0,0,0,1,1,0|1,0,1]=4 145 B13R2.64 C1=CC(=CN=C1)NC2=NCCS2 Z234896765 [0,0,0,1,1,0|2,0,0]=4 146 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 Z1255415487 [0,0,0,1,1,0|0,0,0]=2 147 B13R2.64 C1=CC=C(C=C1)CC2=NN=CN2 Z1262564339 [0,0,0,1,1,0|1,0,1]=4 148 B13R2.64 C1=CC=C(C=C1)CC2=NN=NN2 Z1000626 [0,0,0,1,1,0|2,0,0]=4 149 B13R2.64 C1=CC=C(C=C1)CC2CCCN2 Z237735126 [0,0,0,1,1,0|1,0,1]=4 150 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 Z56755591 [0,0,0,1,1,0|1,0,0]=3 151 B15R2.15 CNC1CCN(C1)CC2=CC=CC=C2 Z159528466 [0,0,0,1,0,1|1,0,1]=4 152 B15R2.15 O/N=C\1/CCN(C1)CC2=CC=CC=C2 Z217709970 [0,0,0,1,0,1|2,0,0]=4 153 B15R2.2196 C1=CC=C(C=C1)CCNC2=NCCS2 Z56896214 [0,0,0,1,0,1|1,0,0]=3 154 B15R2.4808 C/N=C\1/SC=C(N1C)C2=CC=CC=C2 Z56933423 [0,0,0,1,0,1|1,0,1]=4 155 B15R2.128 CCC1CN(C2=C(C=CC=C2)CN1)C Z1359426866 [0,1,0,1,0,0|1,0,1]=4 156 B15R2.1259 CC(NC1=NCCS1)C2=CC=CC=C2 Z56839765 [0,1,0,1,0,0|1,0,0]=3 157 B15R2.1259 O=C(NC1=NCCS1)C2=CC=CC=C2 Z30009147 [0,1,0,1,0,0|1,0,1]=4 158 B15R2.562 BrC1=C(C=CC=C1)CSC2=NCCN2 Z228497876 [0,1,0,1,0,0|1,0,0]=3 159 B15R2.562 FC1=C(C=CC=C1)CSC2=NCCN2 Z57470394 [0,1,0,1,0,0|1,0,0]=3 160 B15R2.100 CC1=CC=C(C=C1)CSC2=NCCS2 Z19630672 [0,1,0,1,0,0|2,0,0]=4 161 B15R2.100 ClC1=CC=C(C=C1)CNC2=NCCS2 Z367660566 [0,1,0,1,0,0|1,0,0]=3 162 B15R2.100 ClC1=CC=C(C=C1)CSC2=NCCN2 Z48834205 [0,1,0,1,0,0|1,0,0]=3 163 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCN2 Z48834218 [0,1,0,1,0,0|1,0,0]=3 164 B15R2.100 FC1=CC=C(C=C1)CSC2=NCCS2 Z19631284 [0,1,0,1,0,0|2,0,0]=4 165 B15R2.275 CNC1=NN=C(N1)C2=CC=C(C=C2)Br Z2408581817 [0,1,0,1,0,0|1,0,1]=4 166 B15R2.1117 BrC1=CC(=CC=C1)CSC2=NCCN2 Z216501478 [0,1,0,1,0,0|1,0,0]=3 167 B15R2.1117 CC1=CC(=CC=C1)CSC2=NCCS2 Z19631672 [0,1,0,1,0,0|2,0,0]=4 168 B15R2.1117 ClC1=CC(=CC=C1)CSC2=NCCS2 Z19631280 [0,1,0,1,0,0|2,0,0]=4 169 B15R2.1117 FC1=CC(=CC=C1)CSC2=NCCS2 Z19630733 [0,1,0,1,0,0|2,0,0]=4 170 B15R2.55 CN1C=CN=C1SCC2=CC=CC=C2 Z18499767 [0,1,0,1,0,0|1,0,1]=4 171 B15R2.55 CN1CCN=C1NCC2=CC=CC=C2 Z3210132368 [0,1,0,1,0,0|0,0,0]=2 172 B15R2.55 CN\1CCS/C1=N\CC2=CC=CC=C2 Z48963488 [0,1,0,1,0,0|1,0,1]=4 173 B15R2.66 CCNC1=NCC(S1)C2=CC=CC=C2 Z422704880 [0,1,0,1,0,0|1,0,0]=3 174 B15R2.283 CC1=CN=C(S1)NCC2=CC=CC=C2 Z1269223729 [0,1,0,1,0,0|1,0,1]=4 175 B15R2.283 CC1=NN=C(N1)SCC2=CC=CC=C2 Z57725004 [0,1,0,1,0,0|2,0,0]=4 176 B15R2.283 CC1=NOC(=N1)NCC2=CC=CC=C2 Z1255503380 [0,1,0,1,0,0|2,0,0]=4 177 B15R2.283 CC1=NSC(=N1)NCC2=CC=CC=C2 Z1259043228 [0,1,0,1,0,0|2,0,0]=4 178 B15R2.283 CC1CN=C(S1)NCC2=CC=NC=C2 Z56828899 [0,1,0,1,0,0|2,0,0]=4 179 B15R2.283 CN1C=CC(=N1)NCC2=CC=CC=C2 Z558511008 [0,1,0,1,0,0|1,0,1]=4 180 B15R2.2195 C1=CC=C(C=C1)C/N=C\2/NCCCS2 Z48963283 [0,1,0,1,0,0|1,0,1]=4 181 B15R2.2195 C1=CC=C(C=C1)CNC2CCCNC2 Z838921710 [0,1,0,1,0,0|1,0,1]=4 182 B15R2.59 CN(C)C1=NCC(N1)C2=CC=CC=C2 Z3301766443 [0,1,0,1,0,0|0,0,0]=2 183 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [1,0,0,0,1,0|1,0,1]=4 184 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [1,0,0,0,1,0|1,0,1]=4 185 B11R1.40 CN(CC1=CC=CC=C1)N=O Z1198147495 [1,0,0,0,1,0|2,0,0]=4 186 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [1,0,0,0,1,0|1,0,0]=3 187 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [1,0,0,0,1,0|1,0,0]=3 188 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [1,0,0,0,1,0|1,0,1]=4 189 B11R1.40 N/C(=N\O)/CC1=NC=CC=C1 Z285132826 [1,0,0,0,1,0|2,0,0]=4 190 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [1,0,0,0,1,0|1,0,0]=3 191 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [1,0,0,0,1,0|2,0,0]=4 192 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [1,0,0,0,1,0|2,0,0]=4 193 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [1,0,0,0,1,0|2,0,0]=4 194 B13R1.718 CCC(=O)NCCC1=CC=CC=C1 Z27761616 [1,0,0,0,0,1|2,0,0]=4 195 B13R1.718 CCC(=O)NOCC1=CC=CC=C1 Z225862544 [1,0,0,0,0,1|2,0,0]=4 196 B13R1.718 CNC(=O)CNCC1=CC=CC=C1 Z2752927061 [1,0,0,0,0,1|1,0,0]=3 197 B13R1.718 COC(=O)CNCC1=CC=CC=C1 Z138464916 [1,0,0,0,0,1|2,0,0]=4 198 B13R1.718 NNC(=S)NCCC1=CC=CC=C1 Z56828395 [1,0,0,0,0,1|2,0,0]=4