0 B9R1.12 BrCCCN1C=CC=C1 0267AA [0,0,0,0,0,0|3,0,0]=3 1 B9R1.12 CCCCC1=CC=CO1 5552AL [0,0,0,0,0,0|0,0,0]=0 2 B9R1.12 CCCCC1=NN=CO1 6161AC [0,0,0,0,0,0|2,0,0]=2 3 B9R1.12 CCNCC1=CC=CO1 7158AA [0,0,0,0,0,0|1,0,0]=1 4 B9R1.12 CCNCC1=CSC=N1 4173AF [0,0,0,0,0,0|3,0,0]=3 5 B9R1.12 CCOCC1=NC=CN1 V7222 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.12 CNCCC1=CNN=C1 4405AF [0,0,0,0,0,0|4,0,0]=4 7 B9R1.12 N#CCCN1C=CC=N1 1753AF [0,0,0,0,0,0|3,0,1]=4 8 B9R1.12 N#C\C=C\C1=CC=CO1 0767AQ [0,0,0,0,0,0|1,0,3]=4 9 B9R1.12 NCCCC1=CC=CO1 3731AE [0,0,0,0,0,0|1,0,0]=1 10 B9R1.12 NCCCC1=CC=CS1 6482AE [0,0,0,0,0,0|1,1,0]=2 11 B9R1.12 NCCCC1=CNN=C1 7165AD [0,0,0,0,0,0|4,0,0]=4 12 B9R1.12 NCCCN1C=CC=N1 1752AC [0,0,0,0,0,0|3,0,0]=3 13 B9R1.12 O=C=NCC1=CC=CS1 8554AE [0,0,0,0,0,0|2,1,1]=4 14 B9R1.12 OCCCC1=CNN=C1 6612AE [0,0,0,0,0,0|4,0,0]=4 15 B9R1.12 OCCCC1=CON=C1 2312AJ [0,0,0,0,0,0|4,0,0]=4 16 B9R1.12 S=C=NCC1=CC=CO1 4029AE [0,0,0,0,0,0|2,0,1]=3 17 B8R1.8 BrCCC1=CC=CS1 Z5496 [1,0,0,0,0,0|1,1,0]=3 18 B8R1.8 CCCC1=CC=CO1 Z5525 [1,0,0,0,0,0|0,0,0]=1 19 B8R1.8 CCCC1=CSC=C1 Z5466 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.8 CCCC1=NCCO1 5790AL [1,0,0,0,0,0|1,0,2]=4 21 B8R1.8 CCCC1=NN=CO1 5829AA [1,0,0,0,0,0|2,0,0]=3 22 B8R1.8 CCNC1=CC=CS1 W4294 [1,0,0,0,0,0|1,1,0]=3 23 B8R1.8 CCNC1=NC=CS1 4125AJ [1,0,0,0,0,0|2,1,0]=4 24 B8R1.8 CNCC1=CC=CO1 7008AC [1,0,0,0,0,0|1,0,0]=2 25 B8R1.8 CNCC1=CC=NN1 0420AC [1,0,0,0,0,0|3,0,0]=4 26 B8R1.8 CNCC1=CC=NO1 4172AJ [1,0,0,0,0,0|2,0,0]=3 27 B8R1.8 CNCC1=CN=CS1 Z3350 [1,0,0,0,0,0|2,1,0]=4 28 B8R1.8 CNCC1=CSC=N1 3622AA [1,0,0,0,0,0|3,0,0]=4 29 B8R1.8 CNCC1=NC=CN1 4097AE [1,0,0,0,0,0|3,0,0]=4 30 B8R1.8 CNCC1=NC=CS1 4356AD [1,0,0,0,0,0|2,1,0]=4 31 B8R1.8 CNCC1=NOC=C1 4335AJ [1,0,0,0,0,0|3,0,0]=4 32 B8R1.8 CNCC1=NOC=C1 7285AH [1,0,0,0,0,0|3,0,0]=4 33 B8R1.8 ClCCC1=CNC=N1 X4176 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.8 NCCC1=CC=CN1 1070AJ [1,0,0,0,0,0|2,0,0]=3 35 B8R1.8 NCCC1=CSC=C1 8829AB [1,0,0,0,0,0|3,0,0]=4 36 B8R1.8 NCCC1=NC=CN1 9985AA [1,0,0,0,0,0|3,0,0]=4 37 B8R1.8 NCCC1=NC=CS1 5806AE [1,0,0,0,0,0|2,1,0]=4 38 B8R1.8 NCCN1C=CC=C1 3045AB [1,0,0,0,0,0|3,0,0]=4 39 B8R1.8 OCCN1C=CC=C1 4278AL [1,0,0,0,0,0|3,0,0]=4 40 B10R1.11 CCCC(=O)C1=CC=CO1 Z5524 [0,1,0,0,0,0|0,0,1]=2 41 B10R1.11 CCCC(N)C1=CC=CS1 4090AE [0,1,0,0,0,0|0,1,0]=2 42 B10R1.16 CC1=CN(CCCN)N=C1 4394AF [0,1,0,0,0,0|3,0,0]=4 43 B10R1.16 CC1=CSC(CCCN)=N1 8907AC [0,1,0,0,0,0|2,1,0]=4 44 B10R1.16 CC1=NN(CCCN)C=C1 6994AE [0,1,0,0,0,0|3,0,0]=4 45 B10R1.16 CCCCC1=NN=C(N)S1 4170AD [0,1,0,0,0,0|2,1,0]=4 46 B10R1.16 CCCCN1C=C[N+](C)=C1 1196AB [0,1,0,0,0,0|3,0,0]=4 47 B10R1.16 CCCCN1C=C[N+](C)=C1 Y2104 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.16 CCNCC1=CC=C(C)O1 5879AD [0,1,0,0,0,0|1,0,0]=2 49 B10R1.16 CCNCC1=NN=C(C)O1 2038AF [0,1,0,0,0,0|3,0,0]=4 50 B10R1.16 CCOCC1=CNC(Cl)=N1 V8015 [0,1,0,0,0,0|3,0,0]=4 51 B10R1.16 NCCCN1C=C(Cl)C=N1 7222AC [0,1,0,0,0,0|3,0,0]=4 52 B10R1.21 CNCCCC1=CC=CO1 5597AD [0,1,0,0,0,0|0,0,0]=1 53 B10R1.21 NCCCCN1C=CN=C1 0376AD [0,1,0,0,0,0|3,0,0]=4 54 B10R1.21 OCCNCC1=CC=CS1 3616AF [0,1,0,0,0,0|1,1,0]=3 55 B10R1.27 CCC(N)CN1C=CN=C1 V9130 [0,1,0,0,0,0|3,0,0]=4 56 B10R1.27 N[C@H](CO)CC1=CNC=N1 E175 [0,1,0,0,0,0|3,0,0]=4 57 B10R1.29 CC1=CC=NN1CCCN 4404AE [0,1,0,0,0,0|3,0,0]=4 58 B10R1.29 CCCCN1C=CN=C1Cl Y6918 [0,1,0,0,0,0|3,0,0]=4 59 B10R1.29 CCCCN1N=CC=C1I Z9784 [0,1,0,0,0,0|2,0,0]=3 60 B10R1.29 CCNCC1=NC=CN1C 7295AE [0,1,0,0,0,0|3,0,0]=4 61 B10R1.66 CC(=O)CCN1C=CC=N1 2604AF [0,1,0,0,0,0|2,0,1]=4 62 B10R1.66 CC(N)CCC1=CC=CO1 9476AE [0,1,0,0,0,0|0,0,0]=1 63 B10R1.66 CN(C)CCN1C=CC=N1 1505AA [0,1,0,0,0,0|3,0,0]=4 64 B10R1.66 CN(C)\N=C\C1=CC=CO1 0768AQ [0,1,0,0,0,0|2,0,1]=4 65 B10R1.66 NC(=O)NCC1=CC=CO1 8875AB [0,1,0,0,0,0|2,0,1]=4 66 B10R1.66 O=C(O)CCC1=CC=CN1 X6372 [0,1,0,0,0,0|2,0,1]=4 67 B10R1.66 O=C(O)CCC1=CC=NO1 6864AC [0,1,0,0,0,0|2,0,1]=4 68 B8R0.1 C\C=C\C(=O)CCCC 5771AL [0,0,1,0,0,0|0,0,2]=3 69 B8R0.4 C=CCCCCCCC 8130AF [0,0,1,0,0,0|1,0,2]=4 70 B8R0.4 CCCCCC\C=C\I 0029AQ [0,0,1,0,0,0|1,0,2]=4 71 B8R0.4 CCC\C=C/CCCC 7450AL [0,0,1,0,0,0|1,0,2]=4 72 B8R0.4 C\C=C\CCCCCC 9212AL [0,0,1,0,0,0|1,0,2]=4 73 B10R2.7 C1=CC2=C(CCCC2)N1 6444AA [0,0,0,1,0,0|1,0,0]=2 74 B10R2.7 C1=CC2=C(CCNC2)O1 6031AJ [0,0,0,1,0,0|1,0,0]=2 75 B10R2.7 C1=CC2=C(CNCC2)S1 9315AB [0,0,0,1,0,0|1,1,0]=3 76 B10R2.7 C1=NC2=C(CCCC2)N1 1363AB [0,0,0,1,0,0|2,0,0]=3 77 B10R2.7 C1=NC2=C(CNCC2)S1 Z4015 [0,0,0,1,0,0|2,1,0]=4 78 B10R2.7 C1=NN2CCCNC2=C1 Y5255 [0,0,0,1,0,0|3,0,0]=4 79 B10R2.7 C1=NN=C2CCCCN12 6396AE [0,0,0,1,0,0|3,0,0]=4 80 B10R2.7 C1=NNC2=C1CNCC2 X9308 [0,0,0,1,0,0|3,0,0]=4 81 B10R2.136 C1=CSC(C2CCN2)=C1 9646AE [0,0,0,1,0,0|1,1,0]=3 82 B10R2.136 C1=NC(C2CCC2)=NN1 0816AD [0,0,0,1,0,0|3,0,0]=4 83 B10R1.17 CCCCC1=CC=CN=C1 X7086 [0,0,0,0,0,1|1,0,0]=2 84 B10R1.17 CCCCC1=NC=CC=C1 S413 [0,0,0,0,0,1|1,0,0]=2 85 B10R1.17 CCNCC1=CC=CN=C1 Y5832 [0,0,0,0,0,1|2,0,0]=3 86 B10R1.17 CNCCC1=CC=CN=C1 7424AH [0,0,0,0,0,1|2,0,0]=3 87 B10R1.17 CNCCC1=CC=NC=C1 5552AE [0,0,0,0,0,1|2,0,0]=3 88 B10R1.17 CNCCC1=CC=NC=C1 X8552 [0,0,0,0,0,1|2,0,0]=3 89 B10R1.17 CNCCC1=CN=CC=C1 6627AD [0,0,0,0,0,1|2,0,0]=3 90 B10R1.17 COCCC1=NC=CC=C1 4987AL [0,0,0,0,0,1|2,0,0]=3 91 B10R1.17 N#CCCC1=CC=CC=N1 1449AE [0,0,0,0,0,1|2,0,1]=4 92 B10R1.17 N#CCCC1=CC=NC=C1 2937AC [0,0,0,0,0,1|2,0,1]=4 93 B10R1.17 NCCCC1=CC=CC=N1 7820AA [0,0,0,0,0,1|2,0,0]=3 94 B10R1.17 NCCNC1=CC=CC=N1 1624AC [0,0,0,0,0,1|3,0,0]=4 95 B10R1.17 NCCNC1=CC=CN=C1 4424AJ [0,0,0,0,0,1|3,0,0]=4 96 B10R1.17 NCCNC1=NC=CC=N1 4050AD [0,0,0,0,0,1|3,0,0]=4 97 B10R1.17 NCCOC1=CC=CN=C1 Z4583 [0,0,0,0,0,1|3,0,0]=4 98 B10R1.17 NCCOC1=CC=NC=C1 1280AJ [0,0,0,0,0,1|3,0,0]=4 99 B10R1.17 NCCOC1=CC=NC=C1 2194AB [0,0,0,0,0,1|3,0,0]=4 100 B10R1.17 NCCSC1=CC=CC=C1 6800AD [0,0,0,0,0,1|3,0,0]=4 101 B10R1.17 NCCSC1=CC=CC=N1 3135AE [0,0,0,0,0,1|3,0,0]=4 102 B10R1.17 OCCCC1=NC=CC=C1 5625AJ [0,0,0,0,0,1|2,0,0]=3 103 B7R0.1 C=CCOCCCC 7029AL [1,0,1,0,0,0|0,0,1]=3 104 B7R0.1 CCCC\C=C\CO 9204AL [1,0,1,0,0,0|0,0,1]=3 105 B7R0.1 CC\C=C\CCCC 9221AL [1,0,1,0,0,0|0,0,2]=4 106 B7R0.1 C\C=C/CCCCC 7427AL [1,0,1,0,0,0|0,0,2]=4 107 B7R0.1 C\C=C\CCCCC 7960AF [1,0,1,0,0,0|0,0,2]=4 108 B7R0.3 C=C(CC)CCCC 5608AL [1,0,1,0,0,0|0,0,2]=4 109 B7R0.3 C=CC(=O)NCCC 3769AL [1,0,1,0,0,0|1,0,1]=4 110 B7R1.1 CCC1=CC=NO1 3273AB [2,0,0,0,0,0|1,0,0]=3 111 B7R1.1 CCC1=CNC=N1 6226AL [2,0,0,0,0,0|2,0,0]=4 112 B7R1.1 CCC1=NN=CO1 5828AA [2,0,0,0,0,0|2,0,0]=4 113 B7R1.1 CCC1=NNC=C1 6654AA [2,0,0,0,0,0|2,0,0]=4 114 B7R1.1 CNC1=NC=CO1 6947AC [2,0,0,0,0,0|2,0,0]=4 115 B7R1.1 COC1=CC=CO1 2109AL [2,0,0,0,0,0|1,0,0]=3 116 B7R1.1 CSC1=NC=CO1 6777AD [2,0,0,0,0,0|2,0,0]=4 117 B7R1.1 ClCC1=CN=CO1 8892AA [2,0,0,0,0,0|2,0,0]=4 118 B7R1.1 NCC1=CC=CN1 W7617 [2,0,0,0,0,0|2,0,0]=4 119 B7R1.1 NCC1=NC=CO1 0960AA [2,0,0,0,0,0|2,0,0]=4 120 B7R1.1 OCC1=CC=NO1 6850AC [2,0,0,0,0,0|2,0,0]=4 121 B9R1.7 CC1=CC=C(CCN)S1 5238AJ [1,1,0,0,0,0|1,1,0]=4 122 B9R1.7 CC1=CC=C(CCN)S1 9610AD [1,1,0,0,0,0|1,1,0]=4 123 B9R1.7 CCCC1=CSC(N)=N1 Y6326 [1,1,0,0,0,0|2,0,0]=4 124 B9R1.7 CCCC1=NC(C)=CN1 4781AB [1,1,0,0,0,0|2,0,0]=4 125 B9R1.7 CCCC1=NC(N)=NO1 5513AD [1,1,0,0,0,0|2,0,0]=4 126 B9R1.7 CCCC1=NOC(N)=C1 Z2752 [1,1,0,0,0,0|2,0,0]=4 127 B9R1.7 CCCN1C=C(N)C=N1 0139AD [1,1,0,0,0,0|2,0,0]=4 128 B9R1.7 CCCN1C=C(N)C=N1 V2887 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.7 CCCN1C=CC(I)=N1 Z9713 [1,1,0,0,0,0|2,0,0]=4 130 B9R1.7 CCOC1=CC(N)=NO1 5802AJ [1,1,0,0,0,0|2,0,0]=4 131 B9R1.7 CNCC1=CC(Br)=CS1 0077AF [1,1,0,0,0,0|1,1,0]=4 132 B9R1.7 CNCC1=CC(C)=CS1 Y4552 [1,1,0,0,0,0|1,1,0]=4 133 B9R1.7 CNCC1=CC=C(Br)O1 2148AF [1,1,0,0,0,0|1,0,0]=3 134 B9R1.7 CNCC1=CC=C(C)S1 2719AC [1,1,0,0,0,0|1,1,0]=4 135 B9R1.7 CNCC1=CC=C(C)S1 5250AC [1,1,0,0,0,0|1,1,0]=4 136 B9R1.7 NCCC1=CC(Br)=CS1 1027AJ [1,1,0,0,0,0|1,1,0]=4 137 B9R1.7 NCCC1=CC(Br)=CS1 1159AJ [1,1,0,0,0,0|1,1,0]=4 138 B9R1.7 NCCC1=CC=C(Br)S1 1209AJ [1,1,0,0,0,0|1,1,0]=4 139 B9R1.11 CCC(=O)C1=CC=CO1 Z5507 [1,1,0,0,0,0|0,0,1]=3 140 B9R1.11 CCC(N)C1=NC=CS1 X2050 [1,1,0,0,0,0|1,1,0]=4 141 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [1,1,0,0,0,0|0,1,1]=4 142 B9R1.13 CC(C)CN1C=CC=N1 Z0808 [1,1,0,0,0,0|2,0,0]=4 143 B9R1.13 CC(N)CC1=CC=CO1 8493AB [1,1,0,0,0,0|0,0,0]=2 144 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [1,1,0,0,0,0|0,0,0]=2 145 B9R1.13 CN(C)CC1=CC=CS1 2203AB [1,1,0,0,0,0|1,1,0]=4 146 B9R1.33 CN1C=CC=C1CCN 1703AL [1,1,0,0,0,0|2,0,0]=4 147 B9R1.33 CNCC1=C(Br)C=CS1 8509AC [1,1,0,0,0,0|1,1,0]=4 148 B9R1.33 CNCC1=C(C)C=CS1 3445AC [1,1,0,0,0,0|1,1,0]=4 149 B9R1.33 CNCC1=C(C)C=CS1 V8159 [1,1,0,0,0,0|1,1,0]=4 150 B9R1.33 CNCC1=CC=CN1C 8584AD [1,1,0,0,0,0|2,0,0]=4 151 B11R1.1 BrCCCC1=CC=C(Br)C=C1 Y4633 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.1 CCCCC1=CC=C(C)C=C1 Z2332 [0,1,0,0,0,1|1,0,0]=3 153 B11R1.1 CCCCC1=CC=C(Cl)N=C1 6440AA [0,1,0,0,0,1|1,0,0]=3 154 B11R1.1 CCCCC1=CN=C(C)C=C1 5821AH [0,1,0,0,0,1|1,0,0]=3 155 B11R1.1 CCCNC1=NC=C(Br)C=C1 Z6268 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.1 CCCOC1=NC=C(Br)C=C1 V8001 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.1 CCCOC1=NC=C(Br)C=N1 V8664 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.1 CCNCC1=CC=C(N)C=C1 7272AJ [0,1,0,0,0,1|2,0,0]=4 159 B11R1.1 CCNCC1=CC=C(O)C=C1 6053AJ [0,1,0,0,0,1|2,0,0]=4 160 B11R1.1 CCNCC1=CN=C(Cl)C=C1 S696 [0,1,0,0,0,1|2,0,0]=4 161 B11R1.1 CCOCC1=CC=C(O)C=C1 Z4904 [0,1,0,0,0,1|2,0,0]=4 162 B11R1.1 CNCCC1=CC=C(Br)C=C1 V7496 [0,1,0,0,0,1|2,0,0]=4 163 B11R1.1 COCCC1=CC=C(Br)C=C1 V6879 [0,1,0,0,0,1|2,0,0]=4 164 B11R1.1 ClCCCC1=CC=C(Br)C=C1 Y9960 [0,1,0,0,0,1|2,0,0]=4 165 B11R1.1 FC1=CC=C(CCCBr)C=C1 V4639 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.1 NCCCC1=CC=C(Cl)C=C1 9748AA [0,1,0,0,0,1|2,0,0]=4 167 B11R1.1 NCCCC1=CC=C(F)C=C1 3289AD [0,1,0,0,0,1|2,0,0]=4 168 B11R1.1 NCCCC1=CC=C(F)C=C1 7357AC [0,1,0,0,0,1|2,0,0]=4 169 B11R1.1 NCCCC1=CC=C(N)C=C1 9266AB [0,1,0,0,0,1|2,0,0]=4 170 B11R1.1 OCCCC1=CC=C(Br)N=C1 0074AC [0,1,0,0,0,1|2,0,0]=4 171 B11R1.1 OCCCC1=CC=C(F)C=C1 V7380 [0,1,0,0,0,1|2,0,0]=4 172 B11R1.16 CC(CCN)C1=CC=CC=C1 2059AE [0,1,0,0,0,1|2,0,0]=4 173 B11R1.16 CCCC(N)C1=CC=NC=C1 4969AJ [0,1,0,0,0,1|1,0,0]=3 174 B11R1.16 CCCC(N)C1=CN=CC=C1 4944AJ [0,1,0,0,0,1|1,0,0]=3 175 B11R1.16 CCCC(N)C1=NC=CC=C1 5079AC [0,1,0,0,0,1|1,0,0]=3 176 B11R1.16 CCNC(C)C1=CC=CC=C1 7343AC [0,1,0,0,0,1|2,0,0]=4 177 B11R1.16 CNCC(C)C1=CC=CC=C1 3764AF [0,1,0,0,0,1|2,0,0]=4 178 B11R1.16 CNCC(C)C1=CC=CC=C1 6409AE [0,1,0,0,0,1|2,0,0]=4 179 B11R1.16 ClCCC(Br)C1=CC=CC=C1 V4390 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.17 CCCNC1=C(Cl)C=CC=C1 5500AE [0,1,0,0,0,1|2,0,0]=4 181 B11R1.17 CCCNC1=NC=CC=C1N 3687AE [0,1,0,0,0,1|2,0,0]=4 182 B11R1.17 CCCOC1=NC=CC=C1N 8654AB [0,1,0,0,0,1|2,0,0]=4 183 B11R1.17 CCNCC1=C(O)C=CC=C1 5372AJ [0,1,0,0,0,1|2,0,0]=4 184 B11R1.17 CCNCC1=NC=CC=C1C 4242AF [0,1,0,0,0,1|2,0,0]=4 185 B11R1.17 CCSCC1=CC=CC=C1Br V9925 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.17 CNCCC1=C(F)C=CC=C1 4862AJ [0,1,0,0,0,1|2,0,0]=4 187 B11R1.17 ClC1=CC=CC=C1CCCBr V6557 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.17 FC1=CC=CC=C1CCCBr Z9473 [0,1,0,0,0,1|2,0,0]=4 189 B11R1.17 OCCCC1=C(O)C=CN=C1 0921AD [0,1,0,0,0,1|2,0,0]=4 190 B11R1.24 CC1=CC(CCCO)=CC=C1 3205AH [0,1,0,0,0,1|2,0,0]=4 191 B11R1.24 CCCNC1=CC(C)=CC=C1 4247AD [0,1,0,0,0,1|2,0,0]=4 192 B11R1.24 CCCNC1=CC(Cl)=CC=C1 9833AD [0,1,0,0,0,1|2,0,0]=4 193 B11R1.24 CCCNC1=NC=CC(Br)=C1 Z9400 [0,1,0,0,0,1|2,0,0]=4 194 B11R1.24 CCCOC1=NC(C)=CN=C1 0447AC [0,1,0,0,0,1|2,0,0]=4 195 B11R1.24 CCOCC1=NC(N)=CC=N1 3327AB [0,1,0,0,0,1|2,0,0]=4 196 B11R1.24 CNCCC1=CC(C)=CC=C1 V2677 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.24 CNCCC1=CC=CC(Cl)=C1 V6388 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.24 CNCCC1=CC=CC(F)=C1 V6333 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.24 ClC1=CC(CCCBr)=CC=C1 V8963 [0,1,0,0,0,1|2,0,0]=4 200 B11R1.24 OCCCC1=CC(O)=CC=C1 W3104 [0,1,0,0,0,1|2,0,0]=4 201 B11R1.24 OCCCC1=CC=CC(Cl)=C1 V4535 [0,1,0,0,0,1|2,0,0]=4 202 B11R1.28 CNCCCC1=CC=CC=C1 1600AB [0,1,0,0,0,1|1,0,0]=3 203 B11R1.28 CNCCCC1=CC=CC=C1 3594AL [0,1,0,0,0,1|1,0,0]=3 204 B11R1.28 CNCCCC1=CC=CC=N1 7821AA [0,1,0,0,0,1|1,0,0]=3 205 B11R1.28 ClCCCOC1=CC=CC=C1 0684AE [0,1,0,0,0,1|2,0,0]=4 206 B11R1.28 ClCCNCC1=CC=CC=C1 3046AE [0,1,0,0,0,1|2,0,0]=4 207 B11R1.28 ClCCNCC1=CC=CC=C1 7007AE [0,1,0,0,0,1|2,0,0]=4 208 B11R1.28 ClCCOCC1=CC=CC=C1 8862AA [0,1,0,0,0,1|2,0,0]=4 209 B11R1.28 OCCCCC1=CC=CN=C1 5963AJ [0,1,0,0,0,1|1,0,0]=3 210 B11R1.28 OCCCCC1=CC=NC=C1 5977AJ [0,1,0,0,0,1|1,0,0]=3 211 B11R1.28 OCCCCC1=NC=CC=C1 6014AJ [0,1,0,0,0,1|1,0,0]=3 212 B11R1.28 OCCNCC1=CC=CC=N1 0192AC [0,1,0,0,0,1|2,0,0]=4 213 B11R1.28 OCCNCC1=CC=CN=C1 8414AE [0,1,0,0,0,1|2,0,0]=4 214 B11R1.40 CC(CN)CC1=CC=CC=C1 2217AC [0,1,0,0,0,1|2,0,0]=4 215 B11R1.40 CNC(C)CC1=NC=CN=C1 3718AF [0,1,0,0,0,1|2,0,0]=4 216 B11R1.91 CC(C)NCC1=CN=CC=C1 7190AJ [0,1,0,0,0,1|2,0,0]=4 217 B11R1.91 CC(Cl)COC1=CC=CC=C1 4945AL [0,1,0,0,0,1|2,0,0]=4 218 B11R1.91 CC(N)COC1=CC=CC=C1 4356AB [0,1,0,0,0,1|2,0,0]=4 219 B11R1.15 CCCC(=O)C1=CC=C(Br)S1 8324AC [0,2,0,0,0,0|0,1,1]=4 220 B11R1.15 CCNC(=O)C1=CC=C(Br)O1 5338AE [0,2,0,0,0,0|1,0,1]=4 221 B11R1.29 CCCCC(=O)C1=CC=CO1 Z5508 [0,2,0,0,0,0|0,0,0]=2 222 B11R1.29 CCCCC(=O)C1=CC=CS1 Z5534 [0,2,0,0,0,0|0,1,0]=3 223 B11R1.29 CCSCC(=O)C1=CC=CS1 5708AB [0,2,0,0,0,0|0,1,1]=4 224 B11R1.29 CNCCC(O)C1=CC=CS1 2706AA [0,2,0,0,0,0|0,1,0]=3 225 B11R1.29 NCCNC(=O)C1=CC=CO1 0052AF [0,2,0,0,0,0|1,0,1]=4 226 B11R1.77 NC(CC(=O)O)C1=CC=CO1 1415AC [0,2,0,0,0,0|1,0,1]=4 227 B11R1.27 CC1=CC=C(CNCCO)O1 7558AD [0,2,0,0,0,0|1,0,0]=3 228 B11R1.75 CC1=CC=C(CNC(C)C)O1 0886AF [0,2,0,0,0,0|1,0,0]=3 229 B11R1.214 CCCCC1=CC=C(C=O)S1 4651AF [0,2,0,0,0,0|0,1,0]=3 230 B11R1.4 CC#CCNCC1=CC=CO1 0281AD [0,2,0,0,0,0|0,0,1]=3 231 B11R1.4 CCCCOCC1=CC=CO1 Y1589 [0,2,0,0,0,0|0,0,0]=2 232 B11R1.4 COCCNCC1=CC=CS1 0723AF [0,2,0,0,0,0|0,1,0]=3 233 B11R1.4 COCCNCC1=CSC=C1 1714AF [0,2,0,0,0,0|2,0,0]=4 234 B11R1.4 COCCNCC1=NC=CS1 1975AF [0,2,0,0,0,0|1,1,0]=4 235 B11R1.4 NCCCNCC1=CC=CO1 7438AD [0,2,0,0,0,0|0,0,0]=2 236 B11R1.25 CNC(C)CCC1=CC=CO1 5055AD [0,2,0,0,0,0|0,0,0]=2 237 B11R1.25 COC(=O)CCC1=CC=CS1 8609AA [0,2,0,0,0,0|0,1,1]=4 238 B11R1.25 NCC(=O)NCC1=CC=CO1 0043AD [0,2,0,0,0,0|1,0,1]=4 239 B11R1.172 O=C(O)CSCC1=CC=CO1 2370AF [0,2,0,0,0,0|1,0,1]=4 240 B11R1.180 CCOCOC1=C(C)C=CO1 V8888 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O G556 [0,2,0,0,0,0|1,0,1]=4 242 B11R1.510 CC(C)(C)NCC1=CC=CO1 9662AC [0,2,0,0,0,0|1,0,0]=3 243 B11R1.510 CC(C)(C)NCC1=CC=CS1 V5328 [0,2,0,0,0,0|1,1,0]=4 244 B9R2.2 C1=CN(C2CC2)C=C1 4548AE [1,0,0,1,0,0|2,0,0]=4 245 B9R2.2 C1=CNC(C2CC2)=N1 5533AJ [1,0,0,1,0,0|2,0,0]=4 246 B9R2.3 C1=NN2CCCC2=C1 1601AA [1,0,0,1,0,0|2,0,0]=4 247 B11R2.1 NC1CCC2=C1N=CC=C2 9677AA [0,0,0,1,0,1|2,0,0]=4 248 B11R2.1 NC1CCC2=CC=CN=C21 3374AJ [0,0,0,1,0,1|2,0,0]=4 249 B11R2.1 O[C@H]1CCC2=CC=CN=C21 4628AC [0,0,0,1,0,1|2,0,0]=4 250 B11R2.4 NC1CC1C2=CC=CC=C2 2168AL [0,0,0,1,0,1|2,0,0]=4 251 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8297AH [0,0,0,1,0,1|2,0,0]=4 252 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 8412AH [0,0,0,1,0,1|2,0,0]=4 253 B11R2.20 C1=CC2=C(C=N1)CCNC2 W5369 [0,0,0,1,0,1|2,0,0]=4 254 B11R2.20 C1=CC2=C(CCNC2)N=C1 W8563 [0,0,0,1,0,1|2,0,0]=4 255 B11R2.20 C1=CC2=C(CNCC2)N=C1 6451AA [0,0,0,1,0,1|2,0,0]=4 256 B11R2.20 C1=CC2=C(CNCC2)N=C1 Z4098 [0,0,0,1,0,1|2,0,0]=4 257 B11R2.20 C1=CN=C2CCCOC2=C1 8439AE [0,0,0,1,0,1|2,0,0]=4 258 B11R2.20 C1=NC=C2CCNCC2=C1 9567AH [0,0,0,1,0,1|2,0,0]=4 259 B11R2.20 C1=NC=NC2=C1CNCC2 W4126 [0,0,0,1,0,1|2,0,0]=4 260 B11R2.20 C1=NC=NC2=C1CNCC2 W4399 [0,0,0,1,0,1|2,0,0]=4 261 B11R2.2 C1=CNC(C2=NCCC2)=C1 7287AC [0,1,0,1,0,0|1,0,1]=4 262 B11R2.2 C1=COC(C2NCCS2)=C1 4793AE [0,1,0,1,0,0|1,0,0]=3 263 B11R2.2 C1=CSC(C2CCCN2)=C1 Q597 [0,1,0,1,0,0|0,1,0]=3 264 B11R2.2 C1=CSC(N2CCCC2)=N1 V6382 [0,1,0,1,0,0|1,1,0]=4 265 B11R2.57 OC1(C2=NC=CS2)CCC1 4602AB [0,1,0,1,0,0|1,1,0]=4 266 B11R2.106 CC1NCCN2C=CC=C12 W8170 [0,1,0,1,0,0|2,0,0]=4 267 B11R2.106 NC1CCCC2=C1C=CS2 6003AE [0,1,0,1,0,0|0,1,0]=3 268 B11R2.10 CC1=NC2=C(CCNC2)O1 1794AJ [0,1,0,1,0,0|2,0,0]=4 269 B11R2.10 NC1=NC2=C(CCCC2)S1 5520AH [0,1,0,1,0,0|1,1,0]=4 270 B11R2.351 BrC1=CN(CC2CC2)N=C1 Z8423 [0,1,0,1,0,0|2,0,0]=4 271 B11R2.352 NC1=NN=C(C2CCC2)O1 2333AF [0,1,0,1,0,0|2,0,0]=4 272 B11R2.352 OC1=NN=C(C2CCC2)O1 3217AD [0,1,0,1,0,0|2,0,0]=4 273 B11R2.18 C1=NN2CCCNCC2=C1 9527AJ [0,1,0,1,0,0|2,0,0]=4 274 B11R2.385 C1=CSC(CNC2CC2)=C1 V3349 [0,1,0,1,0,0|0,1,0]=3 275 B11R2.36 CC1CCC2=NNC=C2C1 Z8633 [0,1,0,1,0,0|2,0,0]=4 276 B11R2.115 IC1=CC=NN1CC2CC2 Z9776 [0,1,0,1,0,0|2,0,0]=4