0 B11R1.182 CC1=C(N=S=O)C=C(Cl)C=C1 ALBB-026526 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.182 CC1=CC(N=C=O)=C(C)C=C1 ALBB-007507 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.182 CC1=CC(N=S=O)=C(C)C=C1 ALBB-026540 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.182 CC1=CC=C(C)C(N=[N+]=[N-])=C1 ALBB-032804 [0,0,0,0,0,0|2,0,1]=3 4 B11R1.182 CC1=CC=C(Cl)C=C1N=C=O ALBB-007512 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.182 CC1=CC=C(F)C(N=S=O)=C1 ALBB-026564 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.182 CC1=CC=C(F)C=C1N=S=O ALBB-026562 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.182 CCNC1=C(O)C=CC(C)=C1 ALBB-024259 [0,0,0,0,0,0|3,0,0]=3 8 B10R1.4 CC1=CC=CC=C1N=S=O ALBB-026544 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.4 CC1=CC=CC=C1N=[N+]=[N-] ALBB-032793 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.4 CCNC1=CC=CC=C1C ALBB-033822 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.4 CCNC1=CC=CC=C1N ALBB-016491 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.4 CNCC1=CC=CC=C1C ALBB-013357 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.4 CNCC1=CC=CC=C1C ALBB-013357 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.4 N#CCC1=C(Cl)C=CC=C1 ALBB-016811 [1,0,0,0,0,0|1,0,2]=4 15 B10R1.4 NNCC1=CC=CC=C1Cl ALBB-016407 [1,0,0,0,0,0|2,0,0]=3 16 B10R1.4 NNCC1=CC=CC=C1Cl ALBB-016407 [1,0,0,0,0,0|2,0,0]=3 17 B10R1.10 CC1=CC(N=C=O)=CC=C1 ALBB-020889 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.10 CC1=CC(N=S=O)=CC=C1 ALBB-026543 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.10 CC1=CC=CC(N=[N+]=[N-])=C1 ALBB-032792 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.10 CCNC1=CC(C)=CC=C1 ALBB-020271 [1,0,0,0,0,0|2,0,0]=3 21 B10R1.10 CCNC1=CC(Cl)=CC=C1 ALBB-012137 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.30 CC1=CC(CCl)=C(C)C=C1 ALBB-005971 [1,0,0,0,0,0|1,0,0]=2 23 B10R1.30 CC1=CC=C(C)C(NN)=C1 ALBB-006078 [1,0,0,0,0,0|1,0,0]=2 24 B10R1.30 FC1=CC(CCl)=C(F)C=C1 ALBB-006037 [1,0,0,0,0,0|3,0,0]=4 25 B10R1.30 NCC1=C(F)C=CC(F)=C1 ALBB-005359 [1,0,0,0,0,0|2,0,0]=3 26 B12R1.268 COC1=C(N=C=O)C=C(C)C=C1 ALBB-003037 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.354 CC1=CC=C(O)C(C(=O)CCl)=C1 ALBB-023725 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.354 CC1=CC=C(O)C(C(=O)NN)=C1 ALBB-032128 [0,1,0,0,0,0|2,0,1]=4 29 B12R1.354 CCC(=O)C1=CC(C)=CC=C1C ALBB-002888 [0,1,0,0,0,0|1,0,1]=3 30 B12R1.354 CCC(N)C1=C(Cl)C=CC(Cl)=C1 ALBB-010233 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.374 CC1=CC(OCCN)=C(Cl)C=C1 ALBB-010449 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.374 CC1=CC=C(C)C(OCCN)=C1 ALBB-025710 [0,1,0,0,0,0|0,0,0]=1 33 B12R1.374 CCCNC1=CC(C)=CC=C1C ALBB-020231 [0,1,0,0,0,0|1,0,0]=2 34 B12R1.374 NCCOC1=C(Cl)C=CC(Cl)=C1 ALBB-010432 [0,1,0,0,0,0|2,0,0]=3 35 B12R2.24 NC1=CC2=C(C=C1)CCCC2 ALBB-025795 [0,0,0,1,0,0|2,0,0]=3 36 B12R2.606 CC1=CC2=C(C=C1)N=C(N)S2 ALBB-021281 [0,0,0,1,0,0|2,0,1]=4 37 B10R1.187 CC1=NNC(C)=C1CCCl ALBB-006734 [0,0,0,0,1,0|3,0,0]=4 38 B10R1.187 CC1=NOC(C)=C1CCN ALBB-004640 [0,0,0,0,1,0|2,0,0]=3 39 B10R1.187 CC1=NOC(C)=C1CCN ALBB-004640 [0,0,0,0,1,0|2,0,0]=3 40 B10R1.187 CC1=NOC(C)=C1CCS ALBB-006735 [0,0,0,0,1,0|3,0,0]=4 41 B9R1.8 BrCCC1=NC=CC=C1 ALBB-016283 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.8 NCCC1=CC=CN=C1 ALBB-006042 [2,0,0,0,0,0|1,0,0]=3 43 B9R1.8 NCCC1=CC=NC=C1 ALBB-000247 [2,0,0,0,0,0|1,0,0]=3 44 B9R1.8 NCCC1=CC=NC=C1 ALBB-000247 [2,0,0,0,0,0|1,0,0]=3 45 B9R1.8 NCCC1=NC=CC=C1 ALBB-006016 [2,0,0,0,0,0|1,0,0]=3 46 B9R1.8 NNCC1=CC=CC=C1 ALBB-029808 [2,0,0,0,0,0|1,0,0]=3 47 B9R1.8 OCCC1=NC=CC=C1 ALBB-020942 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.15 CC1=C(NN)C=CC=C1 ALBB-005955 [2,0,0,0,0,0|1,0,0]=3 49 B9R1.15 CC1=C(NN)C=CC=C1 ALBB-005955 [2,0,0,0,0,0|1,0,0]=3 50 B9R1.15 CC1=CC=CC=C1CN ALBB-027035 [2,0,0,0,0,0|0,0,0]=2 51 B9R1.15 CC1=CC=CN=C1NN ALBB-011831 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.15 CC1=NC=CC=C1CCl ALBB-022808 [2,0,0,0,0,0|2,0,0]=4 53 B9R1.15 CNC1=CC=CC=C1N ALBB-012420 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.15 CNC1=CC=CC=C1N ALBB-012420 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.15 CSC1=C(N)C=CC=C1 ALBB-033047 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.15 NCC1=C(N)C=CC=C1 ALBB-006006 [2,0,0,0,0,0|1,0,0]=3 57 B9R1.15 NNC1=C(F)C=CC=C1 ALBB-005977 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.15 NNC1=CC=CC=C1Br ALBB-014120 [2,0,0,0,0,0|2,0,0]=4 59 B9R1.15 NNC1=CC=CC=C1Cl ALBB-005963 [2,0,0,0,0,0|2,0,0]=4 60 B9R1.2 CC1=CC(NN)=NC=C1 ALBB-011830 [2,0,0,0,0,0|2,0,0]=4 61 B9R1.2 CC1=CC=CC(CN)=C1 ALBB-005972 [2,0,0,0,0,0|0,0,0]=2 62 B9R1.2 CCC1=CC(O)=CC=C1 ALBB-026446 [2,0,0,0,0,0|1,0,0]=3 63 B9R1.2 NCC1=CC=CC(F)=C1 ALBB-007577 [2,0,0,0,0,0|1,0,0]=3 64 B9R1.2 NNC1=CC(Cl)=CC=C1 ALBB-005985 [2,0,0,0,0,0|2,0,0]=4 65 B9R1.2 NNC1=CC=CC(F)=C1 ALBB-005989 [2,0,0,0,0,0|2,0,0]=4 66 B9R1.69 CC1=C(O)C=C(O)C=C1 ALBB-023628 [2,0,0,0,0,0|2,0,0]=4 67 B9R1.69 CC1=CC(S)=C(S)C=C1 ALBB-035711 [2,0,0,0,0,0|2,0,0]=4 68 B9R1.69 CC1=CC=C(Cl)C(N)=C1 ALBB-022600 [2,0,0,0,0,0|1,0,0]=3 69 B9R1.69 CC1=CC=C(O)C(N)=N1 ALBB-014348 [2,0,0,0,0,0|2,0,0]=4 70 B9R1.69 NC1=C(N)C=C(Br)C=C1 ALBB-006246 [2,0,0,0,0,0|2,0,0]=4 71 B9R1.69 NC1=C(O)C=CC(F)=C1 ALBB-027291 [2,0,0,0,0,0|2,0,0]=4 72 B11R1.17 CC1=CC=CC=C1CNC#N ALBB-014571 [1,1,0,0,0,0|0,0,2]=4 73 B11R1.17 CC1=CC=CC=C1OCCN ALBB-010256 [1,1,0,0,0,0|0,0,0]=2 74 B11R1.17 CC1=CC=CC=C1OCCN ALBB-010256 [1,1,0,0,0,0|0,0,0]=2 75 B11R1.17 CCCOC1=C(N)C=CC=C1 ALBB-020970 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.17 CCCOC1=C(N)C=CC=C1 ALBB-020970 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.17 FC1=C(OCCBr)C=CC=C1 ALBB-025810 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.17 NCCOC1=C(F)C=CC=C1 ALBB-010290 [1,1,0,0,0,0|1,0,0]=3 79 B11R1.17 NCCOC1=CC=CC=C1Cl ALBB-010287 [1,1,0,0,0,0|1,0,0]=3 80 B11R1.17 NCCOC1=CC=CC=C1Cl ALBB-010287 [1,1,0,0,0,0|1,0,0]=3 81 B11R1.17 OCCOC1=CC=CC=C1Cl ALBB-031252 [1,1,0,0,0,0|2,0,0]=4 82 B11R1.41 CCNC1=CC=CC=C1OC ALBB-033793 [1,1,0,0,0,0|2,0,0]=4 83 B11R1.41 CCOC1=C(CN)C=CC=C1 ALBB-005366 [1,1,0,0,0,0|2,0,0]=4 84 B11R1.41 CNCC1=C(OC)C=CC=C1 ALBB-027041 [1,1,0,0,0,0|2,0,0]=4 85 B11R1.41 COC1=C(CC#N)C=CC=C1 ALBB-023714 [1,1,0,0,0,0|0,0,2]=4 86 B11R1.41 COC1=C(CNN)C=CC=C1 ALBB-018313 [1,1,0,0,0,0|1,0,0]=3 87 B11R1.86 CC1=C(CC(=O)Cl)C=CC=C1 ALBB-031004 [1,1,0,0,0,0|1,0,1]=4 88 B11R1.86 CC1=CC=CN=C1CC(C)O ALBB-014212 [1,1,0,0,0,0|2,0,0]=4 89 B11R1.86 NC(=O)CC1=CC=CC=C1O ALBB-026230 [1,1,0,0,0,0|1,0,1]=4 90 B11R1.222 CCC(N)C1=NC=CC=C1C ALBB-011816 [1,1,0,0,0,0|2,0,0]=4 91 B11R1.605 CCNC1=C(C)C=CC=C1C ALBB-033821 [1,1,0,0,0,0|2,0,0]=4 92 B11R1.605 CCNC1=C(C)C=CC=C1C ALBB-033821 [1,1,0,0,0,0|2,0,0]=4 93 B11R1.605 NC1=C(CCO)C(Cl)=CC=C1 ALBB-010315 [1,1,0,0,0,0|2,0,0]=4 94 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 ALBB-002127 [1,1,0,0,0,0|2,0,0]=4 95 B11R1.23 CCC(N)C1=NC=CC(C)=C1 ALBB-011828 [1,1,0,0,0,0|2,0,0]=4 96 B11R1.23 NCC(O)C1=CC=CC(O)=C1 ALBB-006272 [1,1,0,0,0,0|1,0,0]=3 97 B11R1.24 CC1=CC(OCCN)=CC=C1 ALBB-010254 [1,1,0,0,0,0|0,0,0]=2 98 B11R1.24 CC1=CC(OCCN)=CC=C1 ALBB-010254 [1,1,0,0,0,0|0,0,0]=2 99 B11R1.24 CC1=CC=CC(CCCO)=N1 ALBB-005915 [1,1,0,0,0,0|2,0,0]=4 100 B11R1.24 CCCNC1=CC(C)=CC=C1 ALBB-007151 [1,1,0,0,0,0|1,0,0]=3 101 B11R1.24 CCCNC1=CC(Cl)=CC=C1 ALBB-007152 [1,1,0,0,0,0|2,0,0]=4 102 B11R1.24 NCCOC1=CC(Cl)=CC=C1 ALBB-010364 [1,1,0,0,0,0|1,0,0]=3 103 B11R1.24 NCCOC1=CC(F)=CC=C1 ALBB-024579 [1,1,0,0,0,0|1,0,0]=3 104 B11R1.24 OCCOC1=CC=CC(Cl)=C1 ALBB-031251 [1,1,0,0,0,0|2,0,0]=4 105 B11R1.157 CC1=CC(CC(C)O)=NC=C1 ALBB-014211 [1,1,0,0,0,0|2,0,0]=4 106 B11R1.157 CC1=CC=CC(CC(C)O)=N1 ALBB-011863 [1,1,0,0,0,0|2,0,0]=4 107 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 ALBB-004943 [1,1,0,0,0,0|1,0,1]=4 108 B11R1.189 CCOC1=CC=CC(CN)=C1 ALBB-005375 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.189 CNCC1=CC=CC(OC)=C1 ALBB-013359 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.189 CNCC1=CC=CC(OC)=C1 ALBB-013359 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.189 COC1=CC(CNN)=CC=C1 ALBB-012472 [1,1,0,0,0,0|1,0,0]=3 112 B11R1.192 CCNC1=CC(C)=C(C)C=C1 ALBB-012134 [1,1,0,0,0,0|2,0,0]=4 113 B11R1.72 NCC1=C(Cl)C(Cl)=CC=C1N ALBB-024478 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.167 CC1=CC=C(C)C(C(=O)Cl)=C1 ALBB-034794 [1,1,0,0,0,0|1,0,1]=4 115 B11R1.167 CC1=CC=C(C)C(C(C)N)=C1 ALBB-001472 [1,1,0,0,0,0|0,0,0]=2 116 B11R1.280 COC1=CC(CN)=CC=C1O ALBB-006263 [1,1,0,0,0,0|2,0,0]=4 117 B11R1.186 CC1=NN(CCN)C(C)=C1Br ALBB-012448 [0,1,0,0,1,0|2,0,0]=4 118 B11R1.186 CC1=NN(CCN)C(C)=C1Cl ALBB-003700 [0,1,0,0,1,0|2,0,0]=4 119 B11R1.225 CC1=CC(C)=NN1C(C)CN ALBB-021593 [0,1,0,0,1,0|2,0,0]=4 120 B11R1.645 CC1=CC(C)=NN1CC(C)N ALBB-007045 [0,1,0,0,1,0|2,0,0]=4 121 B11R1.465 CC1=NNC(C)=C1CCCN ALBB-006872 [0,1,0,0,1,0|2,0,0]=4 122 B13R1.2872 CC1=CC=C(C)C(NC(=O)CBr)=C1 ALBB-031590 [0,2,0,0,0,0|1,0,1]=4 123 B13R1.2872 CC1=CC=C(C)C(NC(=O)CCl)=C1 ALBB-002263 [0,2,0,0,0,0|1,0,1]=4 124 B13R1.355 CCOC1=C(OC)C=CC(CN)=C1 ALBB-027046 [0,2,0,0,0,0|2,0,0]=4 125 B13R1.257 CC1=CC(S(=O)(=O)NN)=C(C)C=C1 ALBB-002776 [0,2,0,0,0,0|2,0,0]=4 126 B13R1.446 CCCC(=O)C1=C(C)C=CC(C)=C1 ALBB-005948 [0,2,0,0,0,0|1,0,0]=3 127 B13R1.656 CC1=CC(CNCCN)=C(C)C=C1 ALBB-007194 [0,2,0,0,0,0|0,0,0]=2 128 B13R1.893 CC1=CC=C(C)C(OCC(=O)Cl)=C1 ALBB-011359 [0,2,0,0,0,0|1,0,1]=4 129 B13R1.893 CC1=CC=C(C)C(OCC(=O)O)=C1 ALBB-000967 [0,2,0,0,0,0|1,0,1]=4 130 B11R1.1 CC1=CC=C(OCCN)C=C1 ALBB-010246 [0,0,1,1,0,0|1,0,1]=4 131 B11R1.1 CC1=CC=C(OCCN)C=C1 ALBB-010246 [0,0,1,1,0,0|1,0,1]=4 132 B11R1.1 CC1=CC=C(SCCN)C=C1 ALBB-013039 [0,0,1,1,0,0|1,0,1]=4 133 B11R2.20 C1=CC=C2OCCCC2=C1 ALBB-025929 [1,0,0,1,0,0|2,0,0]=4 134 B11R2.106 CC1=CC=CC2=C1C=CN2 ALBB-006050 [1,0,0,1,0,0|0,0,2]=4 135 B11R2.36 CC1=CC2=C(C=C1)NC=C2 ALBB-033002 [1,0,0,1,0,0|0,0,2]=4 136 B11R2.36 CC1=CC=C2NC=NC2=C1 ALBB-028791 [1,0,0,1,0,0|1,0,1]=4 137 B13R2.5139 CC1=C2N=C(N)SC2=C(C)C=C1 ALBB-026833 [0,1,0,1,0,0|1,0,1]=4 138 B13R2.43 CC1=CC=C2NC(CN)=NC2=C1 ALBB-006854 [0,1,0,1,0,0|1,0,1]=4 139 B9R1.7 CC1=CSC(CCN)=N1 ALBB-031513 [1,0,0,0,1,0|2,0,0]=4 140 B9R1.27 CC1=NOC(C)=C1CN ALBB-000222 [1,0,0,0,1,0|2,0,0]=4 141 B9R1.27 CC1=NOC(C)=C1CN ALBB-000222 [1,0,0,0,1,0|2,0,0]=4