0 B10R1.4 CC1=C(CNN)C=CC=C1 BB0219970 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.4 CCOC1=CC=CN=C1Br BB0270369 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.4 NCCN1N=CC=CC1=O BB0270149 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.4 NNCC1=C(Cl)C=CC=C1 BB0266305 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.4 O\N=C\C1=C(Cl)C=CC=C1 BB0290874 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.4 O\N=C\C1=C(O)C=CC=C1 BB0290839 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.8 BrCC[N+]1=CC=CC=C1 BB0266020 [1,0,0,0,0,0|2,0,0]=3 7 B9R1.8 CCNC1=CC=CN=C1 BB0269511 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.8 NCCC1=NC=CN=C1 BB0250750 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.8 NNCC1=CC=CC=C1 BB0219935 [1,0,0,0,0,0|1,0,0]=2 10 B9R1.8 OCCC1=CC=CC=C1 BB0267987 [1,0,0,0,0,0|1,0,0]=2 11 B9R1.15 BrCC1=CC=CN=C1Br BB0268113 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 CC1=C(C=O)C=CN=C1 BB0220360 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.15 CC1=C(CCl)C=CC=C1 BB0267833 [1,0,0,0,0,0|1,0,0]=2 14 B9R1.15 CC1=CC=CN=C1C=O BB0220500 [1,0,0,0,0,0|2,0,1]=4 15 B9R1.15 COC1=C(I)C=CC=C1 BB0265900 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.15 ClCC1=C(Cl)C=CC=C1 BB0267828 [1,0,0,0,0,0|2,0,0]=3 17 B9R1.15 FC1=C(CCl)C=CC=C1 BB0267834 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.15 N#CC1=C(Br)C=CC=C1 BB0268023 [1,0,0,0,0,0|1,0,2]=4 19 B9R1.15 N#CC1=C(I)C=CC=C1 BB0268027 [1,0,0,0,0,0|1,0,2]=4 20 B9R1.15 N#CC1=C(N)C=CC=C1 BB0269557 [1,0,0,0,0,0|1,0,2]=4 21 B9R1.15 NCC1=C(I)C=CC=C1 BB0265882 [1,0,0,0,0,0|1,0,0]=2 22 B9R1.15 NCC1=NC=CN=C1Cl BB0268258 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.15 OCC1=C(I)C=CC=C1 BB0265909 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.17 C=CCOC1=C(N)C=CC=C1 BB0288977 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.17 CC1=C(OCCN)C=CC=C1 BB0288800 [0,1,0,0,0,0|0,0,0]=1 26 B11R1.17 CCNCC1=C(Cl)C=CC=C1 BB0289989 [0,1,0,0,0,0|2,0,0]=3 27 B11R1.17 NCCCN1N=CC=CC1=O BB0270148 [0,1,0,0,0,0|3,0,0]=4 28 B11R1.41 CCOC1=C(NC)C=CC=C1 BB0252391 [0,1,0,0,0,0|2,0,0]=3 29 B11R1.41 COC1=C(CNN)C=CC=C1 BB0219964 [0,1,0,0,0,0|1,0,0]=2 30 B11R1.86 CC(C)OC1=C(N)C=CC=C1 BB0292995 [0,1,0,0,0,0|3,0,0]=4 31 B11R1.86 CC1=C(NC(N)=S)C=CC=C1 BB0218375 [0,1,0,0,0,0|1,0,1]=3 32 B11R1.86 CN(C)CC1=C(O)C=CC=C1 BB0288892 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.86 NC(=S)NC1=C(Cl)C=CC=C1 BB0267020 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.86 NC(=S)NC1=C(O)C=CC=C1 BB0245298 [0,1,0,0,0,0|2,0,1]=4 35 B11R1.86 NC1=C(OC(F)F)C=CC=C1 BB0245674 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 BB0269522 [0,1,0,0,0,0|2,0,1]=4 37 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 BB0268068 [0,1,0,0,0,0|2,0,1]=4 38 B11R1.182 CC1=CC(CNN)=C(C)C=C1 BB0270450 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 BB0240952 [0,1,0,0,0,0|1,0,1]=3 40 B11R1.222 NNC(=O)C1=C(N)C=CC=C1 BB0263436 [0,1,0,0,0,0|2,0,1]=4 41 B11R1.605 CC1=CC=CC(C)=C1NC=O BB0293875 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.605 CCOC1=C(Cl)C=CC=C1N BB0216521 [0,1,0,0,0,0|3,0,0]=4 43 B11R2.10 NC1=NC2=C(C=CC=C2)O1 BB0221056 [0,0,0,1,0,0|2,0,1]=4 44 B11R2.10 NC1=NC2=C(C=CC=C2)S1 BB0240617 [0,0,0,1,0,0|2,0,1]=4 45 B11R2.10 O=C1CC2=C(C=CC=C2)N1 BB0257524 [0,0,0,1,0,0|2,0,1]=4 46 B11R2.20 C1=CC2=C(C=C1)NCCN2 BB0237200 [0,0,0,1,0,0|3,0,0]=4 47 B11R2.20 C1=CC2=C(C=C1)OCCN2 BB0237409 [0,0,0,1,0,0|3,0,0]=4 48 B11R2.20 C1=CC2=C(C=N1)CCCN2 BB0270122 [0,0,0,1,0,0|3,0,0]=4 49 B11R2.55 NC1=C(C2CC2)C=CC=C1 BB0221192 [0,0,0,1,0,0|2,0,0]=3 50 B11R2.106 BrC1=C2C=NNC2=CC=C1 BB0268318 [0,0,0,1,0,0|2,0,1]=4 51 B11R2.106 BrC1=C2CNCC2=CC=C1 BB0268326 [0,0,0,1,0,0|3,0,0]=4 52 B11R2.106 CC1=CC=CC2=C1NN=C2 BB0267132 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.33 CC1=C(CCCl)SC=N1 BB0268614 [0,0,0,0,1,0|3,0,0]=4 54 B9R1.33 CC1=C(CCO)SC=N1 BB0267344 [0,0,0,0,1,0|3,0,0]=4 55 B9R1.33 CC1=NC=CN1CCN BB0219985 [0,0,0,0,1,0|2,0,0]=3 56 B9R1.33 CCCN1N=CC=C1C BB0269631 [0,0,0,0,1,0|3,0,0]=4 57 B8R1.2 CCC1=CC=CN=C1 BB0263315 [2,0,0,0,0,0|1,0,0]=3 58 B8R1.2 COC1=CC=CC=C1 BB0266015 [2,0,0,0,0,0|1,0,0]=3 59 B8R1.2 NCC1=CC=CN=C1 BB0216501 [2,0,0,0,0,0|1,0,0]=3 60 B8R1.2 NCC1=CC=CN=N1 BB0268144 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.2 NCC1=NC=CN=C1 BB0237472 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.2 OCC1=NC=CC=C1 BB0265957 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.5 BrC1=C(I)C=CC=C1 BB0268025 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.5 CC1=C(Br)C=NC=C1 BB0263048 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.5 CC1=CC=CN=C1N BB0267617 [2,0,0,0,0,0|1,0,0]=3 66 B8R1.5 CN1C=CC=CC1=S BB0265893 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.5 NC1=C(Br)C=NC=C1 BB0269948 [2,0,0,0,0,0|2,0,0]=4 68 B8R1.5 NC1=C(O)C=CN=C1 BB0260026 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.5 NC1=CC=CN=C1Cl BB0267620 [2,0,0,0,0,0|2,0,0]=4 70 B8R1.5 [BH3-][N+]1=C(C)C=CC=C1 BB0262969 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.1 CC1=CC=C(CNN)C=C1 BB0219962 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.1 N#CCC1=CC=C(N)C=C1 BB0266744 [1,1,0,0,0,0|0,0,2]=4 73 B10R1.1 NNCC1=CC=C(Cl)C=C1 BB0219968 [1,1,0,0,0,0|1,0,0]=3 74 B10R1.1 NNCC1=CC=C(F)C=C1 BB0219969 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.1 OCCC1=CC=C(F)C=C1 BB0267975 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.10 CCNC1=CC(C)=CC=C1 BB0287324 [1,1,0,0,0,0|2,0,0]=4 77 B10R1.10 CCOC1=CC(N)=CC=C1 BB0268130 [1,1,0,0,0,0|2,0,0]=4 78 B10R1.10 CNCC1=CC=CC(F)=C1 BB0270505 [1,1,0,0,0,0|2,0,0]=4 79 B10R1.10 NCCC1=CC=CC(F)=C1 BB0263137 [1,1,0,0,0,0|0,0,0]=2 80 B10R1.10 NNCC1=CC=CC(Cl)=C1 BB0262154 [1,1,0,0,0,0|1,0,0]=3 81 B10R1.10 NNCC1=CC=CC(F)=C1 BB0270294 [1,1,0,0,0,0|1,0,0]=3 82 B10R1.15 CC[C@H](N)C1=CC=CC=C1 BB0293055 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.17 CNCCC1=CC=NC=C1 BB0267842 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.17 NCCCC1=NC=CC=C1 BB0251676 [1,1,0,0,0,0|1,0,0]=3 85 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 BB0269449 [1,1,0,0,0,0|1,0,1]=4 86 B10R1.18 CC(C)NC1=CC=CC=C1 BB0268013 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.18 N=C(N)CC1=CC=CC=C1 BB0240259 [1,1,0,0,0,0|0,0,1]=3 88 B10R1.2 CC1=C(Cl)C=CC=C1NN BB0219958 [1,1,0,0,0,0|1,0,0]=3 89 B10R1.2 COC1=C(C)C(C)=CC=C1 BB0266892 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.20 COC1=C(NN)C=CC=C1 BB0219954 [1,1,0,0,0,0|1,0,0]=3 91 B10R1.25 COC1=C(Br)C=C(Br)C=C1 BB0266844 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.25 COC1=C(Br)C=C(C)C=C1 BB0268095 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.25 COC1=C(I)C=C(N)C=C1 BB0252086 [1,1,0,0,0,0|2,0,0]=4 94 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 BB0267831 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 BB0293233 [1,1,0,0,0,0|1,0,0]=3 96 B10R1.25 OCC1=C(Cl)C=C(Br)C=C1 BB0268627 [1,1,0,0,0,0|2,0,0]=4 97 B10R1.30 CCC1=C(N)C=CC(I)=C1 BB0245924 [1,1,0,0,0,0|1,0,0]=3 98 B10R1.30 COC1=C(N)C=CC(Br)=C1 BB0266754 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.61 CC1=C(C(=O)O)C=CC=C1 BB0269526 [1,1,0,0,0,0|1,0,1]=4 100 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB0254899 [1,1,0,0,0,0|2,0,0]=4 101 B10R1.245 ClCC1=C(Cl)C=CC=C1Cl BB0267829 [1,1,0,0,0,0|2,0,0]=4 102 B10R1.245 FC1=CC=CC(Cl)=C1CCl BB0267827 [1,1,0,0,0,0|2,0,0]=4 103 B10R1.5 CCC1=NC=CN1CCN BB0258761 [0,1,0,0,1,0|2,0,0]=4 104 B10R1.29 CNCCN1C=CN=C1C BB0219986 [0,1,0,0,1,0|2,0,0]=4 105 B10R1.130 CC1=CC(C)=NN1CCN BB0270419 [0,1,0,0,1,0|2,0,0]=4 106 B10R1.187 CC1=NOC(C)=C1CCN BB0220600 [0,1,0,0,1,0|2,0,0]=4 107 B12R1.25 CC1=CC=CC(OCCN)=C1C BB0289615 [0,2,0,0,0,0|0,0,0]=2 108 B12R1.69 CC1=C(NCCO)C=CC(Cl)=C1 BB0266949 [0,2,0,0,0,0|1,0,0]=3 109 B12R1.69 CCCOC1=C(C)C=C(N)C=C1 BB0216526 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.69 CCCOC1=C(N)C=C(F)C=C1 BB0241876 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.69 NCCOC1=C(Cl)C=C(F)C=C1 BB0290836 [0,2,0,0,0,0|1,0,0]=3 112 B12R1.125 CC(C)COC1=C(N)C=CC=C1 BB0290079 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 BB0290026 [0,2,0,0,0,0|2,0,0]=4 114 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 BB0289991 [0,2,0,0,0,0|2,0,0]=4 115 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 BB0221119 [0,2,0,0,0,0|1,0,1]=4 116 B12R1.125 CC1=C(OCC(N)=O)C=CC=C1 BB0244334 [0,2,0,0,0,0|0,0,1]=3 117 B12R1.125 NC(=O)COC1=C(Cl)C=CC=C1 BB0293293 [0,2,0,0,0,0|1,0,1]=4 118 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 BB0290813 [0,2,0,0,0,0|2,0,0]=4 119 B12R1.267 CCCNCC1=C(Cl)C=CC=C1 BB0289992 [0,2,0,0,0,0|2,0,0]=4 120 B12R1.267 CNCCOC1=C(C)C=CC=C1 BB0290076 [0,2,0,0,0,0|0,0,0]=2 121 B12R1.267 CNCCOC1=C(F)C=CC=C1 BB0290356 [0,2,0,0,0,0|1,0,0]=3 122 B12R1.374 CCCOC1=C(N)C=CC(C)=C1 BB0241879 [0,2,0,0,0,0|2,0,0]=4 123 B12R1.77 COC1=C(C(=O)NN)C=CC=C1 BB0282861 [0,2,0,0,0,0|1,0,1]=4 124 B12R1.169 CCNC1=C(OCC)C=CC=C1 BB0294490 [0,2,0,0,0,0|2,0,0]=4 125 B12R1.283 CCOC1=C([C@H](C)N)C=CC=C1 BB0293033 [0,2,0,0,0,0|2,0,0]=4 126 B12R1.1095 CC1=C(CCCl)C(Cl)=NC(Cl)=C1 BB0278623 [0,2,0,0,0,0|2,0,0]=4 127 B12R1.124 CC1=C([C@@H](N)C(=O)O)C=CC=C1 BB0249653 [0,2,0,0,0,0|1,0,1]=4 128 B10R2.7 C1=CC2=C(C=C1)NN=C2 BB0219702 [1,0,0,1,0,0|1,0,1]=4 129 B12R2.202 CC1=C2OC(N)=NC2=CC=C1 BB0267103 [0,1,0,1,0,0|1,0,1]=4 130 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 BB0256889 [0,1,0,1,0,0|2,0,0]=4 131 B12R2.1081 OC1=C2NCCCC2=CC=C1 BB0216335 [0,1,0,1,0,0|2,0,0]=4 132 B12R2.24 ClC1=CN=C2CCNCC2=C1 BB0268323 [0,1,0,1,0,0|1,0,0]=3 133 B12R2.32 NCC1=CC2=C(C=CC=C2)N1 BB0219997 [0,1,0,1,0,0|0,0,2]=4 134 B12R2.32 NCC1=CC2=C(C=CC=C2)O1 BB0270364 [0,1,0,1,0,0|0,0,2]=4 135 B12R2.32 NCC1=NC2=C(C=CC=C2)N1 BB0219571 [0,1,0,1,0,0|1,0,1]=4 136 B12R2.606 C[C@H]1CC2=C(C=CC(Br)=C2)N1 BB0270251 [0,1,0,1,0,0|2,0,0]=4 137 B12R2.606 N[C@H]1CC2=C(C=C(Br)C=C2)C1 BB0252899 [0,1,0,1,0,0|0,0,0]=2 138 B8R1.8 BrCCC1=CC=CS1 BB0256668 [1,0,0,0,1,0|2,0,0]=4 139 B8R1.8 NCCC1=CSC=C1 BB0257696 [1,0,0,0,1,0|1,0,0]=3 140 B8R1.8 NCCN1C=CC=C1 BB0260251 [1,0,0,0,1,0|1,0,0]=3 141 B8R1.8 NCCN1C=CC=N1 BB0267461 [1,0,0,0,1,0|2,0,0]=4 142 B8R1.8 NCCN1C=CN=C1 BB0219897 [1,0,0,0,1,0|2,0,0]=4 143 B8R1.11 CC1=C(CN)C=NN1 BB0267554 [1,0,0,0,1,0|2,0,0]=4 144 B8R1.11 CCC1=CC=NN1C BB0267877 [1,0,0,0,1,0|2,0,0]=4 145 B8R1.11 CCN1N=CC=C1C BB0267875 [1,0,0,0,1,0|2,0,0]=4 146 B8R1.11 CN1C=CC=C1CN BB0262289 [1,0,0,0,1,0|1,0,0]=3 147 B8R1.11 CN1C=CN=C1CN BB0219852 [1,0,0,0,1,0|2,0,0]=4 148 B8R1.11 CN1N=CC=C1CN BB0253800 [1,0,0,0,1,0|2,0,0]=4