0 B11R2.1 NC1=NOC2=C1C=CC=C2 BB0218926 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.1 N[C@H]1CCC2=NC=CC=C21 BB0268261 [0,0,0,0,0,0|3,0,1]=4 2 B11R2.1 SC1=NN=C2C=CC=CN12 BB0270222 [0,0,0,0,0,0|3,1,0]=4 3 B10R2.7 C1=CC2=C(C=C1)NN=C2 BB0219702 [1,0,0,0,0,0|2,0,0]=3 4 B10R2.7 C1=CC2=C(C=N1)NN=C2 BB0272399 [1,0,0,0,0,0|3,0,0]=4 5 B10R2.7 C1=CC2=NSN=C2C=C1 BB0266571 [1,0,0,0,0,0|2,1,0]=4 6 B12R2.1 N#CC1=CNC2=C1C=CC=C2 BB0242412 [0,1,0,0,0,0|3,0,0]=4 7 B12R2.18 CC1=C(C)C2=C(C=CC=C2)N1 BB0268501 [0,1,0,0,0,0|3,0,0]=4 8 B12R2.132 OC1=NNC2=C1C=C(I)C=C2 BB0268362 [0,1,0,0,0,0|2,0,1]=4 9 B12R2.203 NC1=NOC2=CC=CC(F)=C21 BB0259633 [0,1,0,0,0,0|3,0,0]=4 10 B12R2.612 NC1=CC2=C(C=C1)C(=O)OC2 BB0217042 [0,1,0,0,0,0|0,0,0]=1 11 B12R2.612 O=C1CCC2=C1C=CC(Br)=C2 BB0267948 [0,1,0,0,0,0|1,0,0]=2 12 B12R2.2028 N[C@H]1CC(=O)C2=C1C=CC=C2 BB0216357 [0,1,0,0,0,0|1,0,0]=2 13 B10R1.15 C#CC(=O)C1=CC=CC=C1 BB0270313 [0,0,1,0,0,0|1,0,1]=3 14 B10R1.15 CC[C@H](N)C1=CC=CC=C1 BB0293055 [0,0,1,0,0,0|2,0,1]=4 15 B10R1.15 C\C(=N/O)C1=CC=CC=C1 BB0268020 [0,0,1,0,0,0|3,0,0]=4 16 B10R1.17 [N-]=[N+]=NCC1=CC=CC=C1 BB0269449 [0,0,1,0,0,0|3,0,0]=4 17 B10R1.20 N#CC1=C(C=O)C=CC=C1 BB0267783 [0,0,1,0,0,0|1,0,1]=3 18 B10R1.61 CC(=O)C1=CC=CN=C1Cl BB0262982 [0,0,1,0,0,0|3,0,0]=4 19 B10R1.61 CC1=C(C(=O)O)C=CC=C1 BB0269526 [0,0,1,0,0,0|0,0,0]=1 20 B10R1.61 O=C(Cl)C1=C(Br)C=CC=C1 BB0267985 [0,0,1,0,0,0|2,0,0]=3 21 B10R1.61 O=C(O)C1=C(Br)C=CC=C1 BB0285709 [0,0,1,0,0,0|1,0,0]=2 22 B10R1.61 O=C(O)C1=C(Br)C=CC=N1 BB0270076 [0,0,1,0,0,0|2,0,0]=3 23 B10R1.61 O=C(O)C1=C(Br)C=NC=C1 BB0270107 [0,0,1,0,0,0|2,0,0]=3 24 B10R1.61 O=C(O)C1=C(Cl)C=NC=N1 BB0257032 [0,0,1,0,0,0|3,0,0]=4 25 B10R1.61 O=C(O)C1=C(F)C=NC=C1 BB0270722 [0,0,1,0,0,0|2,0,0]=3 26 B10R1.61 O=C(O)C1=C(O)C=CN=C1 BB0269959 [0,0,1,0,0,0|2,0,0]=3 27 B10R1.61 O=C(O)C1=CC=CN=C1S BB0242382 [0,0,1,0,0,0|2,0,0]=3 28 B12R2.24 IC1=CC2=CC=CC=C2C=C1 BB0220370 [0,0,0,0,0,1|2,0,1]=4 29 B12R2.24 NC1=CC2=CC=CC=C2C=C1 BB0266016 [0,0,0,0,0,1|2,0,1]=4 30 B12R2.24 NC1=CC2=CC=CC=C2N=C1 BB0237444 [0,0,0,0,0,1|3,0,0]=4 31 B12R2.24 O=C1CCC2=C(C=NC=N2)C1 BB0267192 [0,0,0,0,0,1|3,0,0]=4 32 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 BB0219703 [0,0,0,0,0,1|2,0,0]=3 33 B12R2.1081 NC1=CC=NC2=CC=CC=C12 BB0270511 [0,0,0,0,0,1|2,0,1]=4 34 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 BB0256889 [0,0,0,0,0,1|2,0,1]=4 35 B12R2.1081 O=C1C=CNC2=C1C=NC=C2 BB0267227 [0,0,0,0,0,1|2,0,1]=4 36 B12R2.1081 O=C1N=NNC2=C1C=CC=C2 BB0276440 [0,0,0,0,0,1|2,0,0]=3 37 B12R2.1081 O=C1NC=NC2=C1C=CC=N2 BB0270225 [0,0,0,0,0,1|2,0,1]=4 38 B12R2.1081 S=C1C=CNC2=C1C=CC=C2 BB0241258 [0,0,0,0,0,1|1,1,1]=4 39 B12R2.1081 SC1=NC=CC2=CC=CC=C21 BB0218925 [0,0,0,0,0,1|1,1,1]=4 40 B9R1.6 C=C(C)C1=CC=CC=C1 BB0220511 [1,0,1,0,0,0|1,0,0]=3 41 B9R1.6 C[C@H](Cl)C1=CC=CC=C1 BB0267980 [1,0,1,0,0,0|1,0,1]=4 42 B9R1.6 C[C@H](O)C1=CC=CC=C1 BB0265980 [1,0,1,0,0,0|0,0,2]=4 43 B9R1.6 O=C(Cl)C1=CN=CC=C1 BB0269554 [1,0,1,0,0,0|2,0,0]=4 44 B9R1.6 O=C(O)C1=CC=CC=C1 BB0269653 [1,0,1,0,0,0|0,0,0]=2 45 B9R1.6 OB(O)C1=CC=CC=C1 BB0287082 [1,0,1,0,0,0|1,0,1]=4 46 B9R1.8 NNCC1=CC=CC=C1 BB0219935 [1,0,1,0,0,0|2,0,0]=4 47 B9R1.8 OCCC1=CC=CC=C1 BB0267987 [1,0,1,0,0,0|0,0,2]=4 48 B9R1.15 CC1=C(C=O)C=CN=C1 BB0220360 [1,0,1,0,0,0|1,0,0]=3 49 B9R1.15 CC1=C(CCl)C=CC=C1 BB0267833 [1,0,1,0,0,0|1,0,1]=4 50 B9R1.15 CC1=CC=CN=C1C=O BB0220500 [1,0,1,0,0,0|1,0,0]=3 51 B9R1.15 ClCC1=C(Cl)C=CC=C1 BB0267828 [1,0,1,0,0,0|2,0,0]=4 52 B9R1.15 FC1=C(CCl)C=CC=C1 BB0267834 [1,0,1,0,0,0|2,0,0]=4 53 B9R1.15 NCC1=C(I)C=CC=C1 BB0265882 [1,0,1,0,0,0|2,0,0]=4 54 B9R1.15 O=CC1=CC=CN=C1Cl BB0269493 [1,0,1,0,0,0|2,0,0]=4 55 B9R1.15 OCC1=C(I)C=CC=C1 BB0265909 [1,0,1,0,0,0|1,0,0]=3 56 B11R1.12 CC\C(=N\O)C1=CC=CC=C1 BB0293018 [0,1,1,0,0,0|1,0,1]=4 57 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB0242877 [0,1,1,0,0,0|1,0,0]=3 58 B11R1.22 COC(=O)C1=CC=C(C)C=C1 BB0258797 [0,1,1,0,0,0|0,0,0]=2 59 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 BB0267982 [0,1,1,0,0,0|0,0,0]=2 60 B11R1.22 COC(=O)C1=CC=C(I)C=C1 BB0268055 [0,1,1,0,0,0|0,0,0]=2 61 B11R1.22 COC(=O)C1=CC=C(N)C=C1 BB0263172 [0,1,1,0,0,0|0,0,0]=2 62 B11R1.22 COC(=O)C1=CC=C(O)C=C1 BB0263150 [0,1,1,0,0,0|0,0,0]=2 63 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 BB0269544 [0,1,1,0,0,0|2,0,0]=4 64 B11R1.22 NNC(=O)C1=CC=C(F)C=C1 BB0240957 [0,1,1,0,0,0|2,0,0]=4 65 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB0269546 [0,1,1,0,0,0|2,0,0]=4 66 B11R1.23 CCC(=O)C1=CC(Cl)=NC=C1 BB0262963 [0,1,1,0,0,0|2,0,0]=4 67 B11R1.23 CNC(=O)C1=CC(N)=CC=C1 BB0242899 [0,1,1,0,0,0|1,0,0]=3 68 B11R1.23 COC(=O)C1=CC(N)=CC=C1 BB0245098 [0,1,1,0,0,0|0,0,0]=2 69 B11R1.23 COC(=O)C1=CC(O)=CC=C1 BB0287095 [0,1,1,0,0,0|0,0,0]=2 70 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 BB0267029 [0,1,1,0,0,0|0,0,0]=2 71 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 BB0258123 [0,1,1,0,0,0|1,0,0]=3 72 B11R1.23 COC(=O)C1=NC=NC(N)=C1 BB0261520 [0,1,1,0,0,0|2,0,0]=4 73 B11R1.23 NNC(=O)C1=CC=CC(I)=C1 BB0272995 [0,1,1,0,0,0|2,0,0]=4 74 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 BB0240952 [0,1,1,0,0,0|2,0,0]=4 75 B11R1.222 CCC(=O)C1=CC=CN=C1Cl BB0262962 [0,1,1,0,0,0|2,0,0]=4 76 B11R1.222 CNC(=O)C1=C(N)C=CC=C1 BB0288006 [0,1,1,0,0,0|1,0,0]=3 77 B11R1.222 COC(=O)C1=C(F)C=CC=C1 BB0269491 [0,1,1,0,0,0|0,0,0]=2 78 B11R1.222 COC(=O)C1=C(I)C=CC=C1 BB0268030 [0,1,1,0,0,0|0,0,0]=2 79 B11R1.222 NNC(=O)C1=C(N)C=CC=C1 BB0263436 [0,1,1,0,0,0|2,0,0]=4 80 B11R1.28 C=CCNCC1=CC=CC=C1 BB0265886 [0,1,1,0,0,0|2,0,0]=4 81 B11R1.91 O=C(O)CCC1=CC=NC=C1 BB0237139 [0,1,1,0,0,0|2,0,0]=4 82 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 BB0268017 [0,1,1,0,0,0|1,0,1]=4 83 B11R1.37 COC1=C(C=O)C=C(Cl)C=C1 BB0254318 [0,1,1,0,0,0|2,0,0]=4 84 B11R1.53 CNC1=C(C(=O)O)C=CC=C1 BB0266926 [0,1,1,0,0,0|2,0,0]=4 85 B11R1.53 NCC1=C(C(=O)O)C=CC=C1 BB0216194 [0,1,1,0,0,0|1,0,0]=3 86 B11R1.53 O=CC1=C(C(=O)O)C=CC=C1 BB0267786 [0,1,1,0,0,0|0,0,1]=3 87 B11R1.265 COC1=C(C=O)C=CC=C1C BB0221326 [0,1,1,0,0,0|2,0,0]=4 88 B11R1.159 CC1=C([N+](=O)[O-])C=CC=C1N BB0293062 [0,1,1,0,0,0|1,0,1]=4 89 B11R1.159 CC1=CC=CC(C(=O)O)=C1O BB0267000 [0,1,1,0,0,0|1,0,0]=3 90 B11R1.159 CN1C=CC=C(C(=O)O)C1=O BB0270496 [0,1,1,0,0,0|2,0,0]=4 91 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 BB0263309 [0,1,1,0,0,0|2,0,0]=4 92 B11R1.159 O=C(O)C1=C(F)C(F)=NC=C1 BB0272409 [0,1,1,0,0,0|2,0,0]=4 93 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O BB0266790 [0,1,1,0,0,0|1,0,0]=3 94 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O BB0266864 [0,1,1,0,0,0|1,0,0]=3 95 B11R1.166 CC1=CC(C)=C(C(N)=O)C=N1 BB0270106 [0,1,1,0,0,0|2,0,0]=4 96 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 BB0267268 [0,1,1,0,0,0|2,0,0]=4 97 B11R1.166 CC1=CC=C(C(=O)O)C(=O)N1 BB0219102 [0,1,1,0,0,0|2,0,0]=4 98 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 BB0268114 [0,1,1,0,0,0|2,0,0]=4 99 B11R1.166 NC(=O)C1=C(N)C=C(Cl)C=C1 BB0217598 [0,1,1,0,0,0|2,0,0]=4 100 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB0267060 [0,1,1,0,0,0|1,0,0]=3 101 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O BB0261924 [0,1,1,0,0,0|2,0,0]=4 102 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 BB0267732 [0,1,1,0,0,0|2,0,0]=4 103 B11R1.167 NC(=O)C1=C(Br)C=CC(Cl)=C1 BB0245680 [0,1,1,0,0,0|2,0,0]=4 104 B11R1.167 NC(=O)C1=C(Br)C=CC(I)=C1 BB0244110 [0,1,1,0,0,0|2,0,0]=4 105 B11R1.167 NC(=O)C1=C(Cl)C=CC(Br)=C1 BB0244281 [0,1,1,0,0,0|2,0,0]=4 106 B11R1.167 NC(=O)C1=C(I)C=CC(I)=C1 BB0244286 [0,1,1,0,0,0|2,0,0]=4 107 B11R1.167 NC(=O)C1=C(N)C=CC(Br)=C1 BB0253301 [0,1,1,0,0,0|2,0,0]=4 108 B11R1.167 NC(=O)C1=C(N)C=CC(I)=C1 BB0257175 [0,1,1,0,0,0|2,0,0]=4 109 B11R1.167 NC(=O)C1=C(O)C=CC(Cl)=C1 BB0293054 [0,1,1,0,0,0|2,0,0]=4 110 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 BB0244022 [0,1,1,0,0,0|1,0,0]=3 111 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 BB0244021 [0,1,1,0,0,0|1,0,0]=3 112 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 BB0244024 [0,1,1,0,0,0|1,0,0]=3 113 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 BB0245937 [0,1,1,0,0,0|1,0,0]=3 114 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 BB0244986 [0,1,1,0,0,0|1,0,0]=3 115 B11R2.10 CC1=CC2=C(C=CC=C2)S1 BB0270588 [1,1,0,0,0,0|2,0,0]=4 116 B11R2.10 O=C1CC2=C(C=CC=C2)N1 BB0257524 [1,1,0,0,0,0|2,0,0]=4 117 B11R2.36 FC1=CC2=C(C=C1)CNC2 BB0268331 [1,1,0,0,0,0|1,0,1]=4 118 B11R2.106 BrC1=C2C=NNC2=CC=C1 BB0268318 [1,1,0,0,0,0|2,0,0]=4 119 B11R2.106 BrC1=C2CNCC2=CC=C1 BB0268326 [1,1,0,0,0,0|1,0,1]=4 120 B11R2.106 CC1=CC=CC2=C1NN=C2 BB0267132 [1,1,0,0,0,0|2,0,0]=4 121 B13R2.57 O=CC1=CC2=C(C=CC=C2)OC1 BB0255285 [0,1,0,0,0,1|2,0,0]=4 122 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O BB0270289 [0,1,0,0,0,1|1,0,1]=4 123 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O BB0258963 [0,1,0,0,0,1|2,0,0]=4 124 B13R2.3683 NC1=CC2=C(C=C1)OC(=O)C=C2 BB0245754 [0,1,0,0,0,1|1,0,1]=4 125 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 BB0216340 [0,2,0,0,0,0|2,0,0]=4 126 B13R2.72 O=C(O)[C@@H]1CCC2=C1C=CC=C2 BB0268222 [0,2,0,0,0,0|1,0,1]=4 127 B13R2.3028 CC1=CC2=C(C=C1)NC(=O)C2=O BB0265911 [0,2,0,0,0,0|2,0,0]=4 128 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BB0258954 [0,2,0,0,0,0|2,0,0]=4 129 B13R2.5190 O=C1NC2=C(C=CC(Cl)=C2)C1=O BB0268090 [0,2,0,0,0,0|2,0,0]=4 130 B13R2.669 COC1=CC2=C(C=C1)CCC2=O BB0268499 [0,2,0,0,0,0|1,0,0]=3 131 B13R2.5187 NC1=CC2=C(C=C1)C(=O)NC2=O BB0217043 [0,2,0,0,0,0|1,0,1]=4 132 B13R2.573 COC1=CC=CC2=C1CCC2=O BB0268360 [0,2,0,0,0,0|1,0,0]=3 133 B13R2.5180 CC1=C(O)C=CC2=C1OCC2=O BB0266132 [0,2,0,0,0,0|2,0,0]=4 134 B13R2.5180 O=C1COC2=C1C=CC(O)=C2O BB0270562 [0,2,0,0,0,0|2,0,0]=4 135 B13R2.582 COC1=C2C(=O)CCC2=CC=C1 BB0268118 [0,2,0,0,0,0|1,0,0]=3 136 B13R2.11642 CC1=C2C(=O)COC2=CC(O)=C1 BB0270203 [0,2,0,0,0,0|2,0,0]=4 137 B13R2.11642 CC1=CC(O)=C2C(=O)COC2=C1 BB0270206 [0,2,0,0,0,0|2,0,0]=4 138 B13R2.2130 COC1=CC2=C(C=C1)C(=O)C=C2 BB0268498 [0,2,0,0,0,0|1,0,1]=4 139 B13R2.2130 COC1=CC2=C(C=C1)C(=O)CC2 BB0268497 [0,2,0,0,0,0|1,0,0]=3 140 B9R1.11 CCC(=O)C1=CC=CS1 BB0268344 [0,0,1,0,1,0|2,0,0]=4 141 B9R1.11 COC(=O)C1=CC=CN1 BB0267781 [0,0,1,0,1,0|1,0,0]=3 142 B9R1.11 COC(=O)C1=CC=CO1 BB0267962 [0,0,1,0,1,0|1,0,0]=3 143 B9R1.11 COC(=O)C1=CC=NN1 BB0258847 [0,0,1,0,1,0|2,0,0]=4 144 B9R1.11 COC(=O)C1=CNN=C1 BB0259302 [0,0,1,0,1,0|2,0,0]=4 145 B9R1.11 COC(=O)C1=CSC=C1 BB0269294 [0,0,1,0,1,0|1,0,0]=3 146 B9R1.41 CC1=C(C(=O)O)SC=N1 BB0241904 [0,0,1,0,1,0|2,0,0]=4 147 B9R1.41 CN1C=CN=C1C(=O)O BB0253147 [0,0,1,0,1,0|2,0,0]=4 148 B9R1.41 CN1N=CC=C1C(=O)O BB0267511 [0,0,1,0,1,0|2,0,0]=4 149 B9R1.41 O=C(O)C1=C(Br)OC=C1 BB0268347 [0,0,1,0,1,0|2,0,0]=4 150 B11R1.86 CC(=O)NC1=C(Br)C=CC=C1 BB0267988 [0,0,1,0,0,1|2,0,0]=4 151 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 BB0269534 [0,0,1,0,0,1|2,0,0]=4 152 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 BB0267066 [0,0,1,0,0,1|2,0,0]=4 153 B11R1.86 CC1=C(NC(N)=S)C=CC=C1 BB0218375 [0,0,1,0,0,1|1,1,0]=4 154 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 BB0269522 [0,0,1,0,0,1|1,0,0]=3 155 B11R1.86 O=C(O)CC1=C(I)C=CC=C1 BB0268068 [0,0,1,0,0,1|1,0,0]=3 156 B13R2.163 O=C1CCCC2=C(C=CC=C2)N1 BB0268558 [0,0,0,0,0,2|1,0,0]=3