0 B11R1.24 C#CCOC1=CC(=CC=C1)Br CDS023209 [0,0,0,0,0,0|2,1,1]=4 1 B11R1.24 CC1=CC(=CC=C1)CCCN CBR00042 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.24 CC1=CC(=CC=C1)CSC#N S411485 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.24 CC1=CC(=CC=C1)OCC#N OTV000130 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.24 CC1=CC(=CC=C1)OCCBr PH000370 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.24 CC1=CC(=CC=C1)OCCO S538558 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.24 CC1=CC=CC(=C1)CCNN PH019073 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.24 CC1=CC=CC(=C1)CN=[N+]=[N-] CDS015331 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.24 CC1=CC=CC(=C1)OCCN R414271 [0,0,0,0,0,0|4,0,0]=4 9 B11R1.24 CCCOC1=CC=CC(=C1)N CDS001846 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.24 COCCC1=CC=CC(=N1)C S369543 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.24 ClC1=CC(=CC=C1)CCCBr PH011322 [0,0,0,0,0,0|2,0,0]=2 12 B11R1.24 N#CCCC1=CC(=CC=C1)Br CDS003023 [0,0,0,0,0,0|2,1,0]=3 13 B11R1.24 NC1=CC=CC(=C1)OCCO CBR00211 [0,0,0,0,0,0|4,0,0]=4 14 B11R1.24 NNCCC1=CC(=CC=C1)F PH019005 [0,0,0,0,0,0|1,1,0]=2 15 B11R1.24 OCCCC1=CC=CC(=C1)Cl PH002730 [0,0,0,0,0,0|2,0,0]=2 16 B11R1.24 OCCOC1=CC=CC(=C1)O CDS003378 [0,0,0,0,0,0|4,0,0]=4 17 B10R1.10 C(=O)CC1=CC=CC(=C1)F CDS021826 [1,0,0,0,0,0|1,1,1]=4 18 B10R1.10 CC1=CC(=CC=C1)CNN CBR00827 [1,0,0,0,0,0|2,0,0]=3 19 B10R1.10 CC1=CC=CC(=N1)CCN CBR01608 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.10 CC1=CC=CC(=N1)CNN PH019298 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.10 CC1=NC(=CC=C1)CCBr CBR02390 [1,0,0,0,0,0|3,0,0]=4 22 B10R1.10 CC1=NC=CC(=C1)CNN PH019247 [1,0,0,0,0,0|3,0,0]=4 23 B10R1.10 CCCC1=CC(=CC=C1)O CDS001518 [1,0,0,0,0,0|1,0,0]=2 24 B10R1.10 CCNC1=CC=CC(=C1)O PH010496 [1,0,0,0,0,0|2,0,0]=3 25 B10R1.10 CCNC1=NC(=NC=C1)Cl CBR00491 [1,0,0,0,0,0|3,0,0]=4 26 B10R1.10 CCOC1=CC(=CC=N1)Br CDS009065 [1,0,0,0,0,0|2,1,0]=4 27 B10R1.10 CCOC1=NC(=CC=C1)Cl S446335 [1,0,0,0,0,0|2,0,0]=3 28 B10R1.10 CCSC1=CC=CC(=C1)Br SYX00287 [1,0,0,0,0,0|1,1,0]=3 29 B10R1.10 CNCC1=CC=CC(=N1)N PH015469 [1,0,0,0,0,0|2,0,0]=3 30 B10R1.10 CNCC1=NC(=CC=C1)C S363774 [1,0,0,0,0,0|2,0,0]=3 31 B10R1.10 CNNC1=CC=CC(=C1)Br PH012299 [1,0,0,0,0,0|1,1,0]=3 32 B10R1.10 COCC1=CC=CC(=N1)C S352160 [1,0,0,0,0,0|3,0,0]=4 33 B10R1.10 CSCC1=CC(=CC=C1)Br EME00017 [1,0,0,0,0,0|1,1,0]=3 34 B10R1.10 CSCC1=NC=CC(=N1)Cl S294187 [1,0,0,0,0,0|3,0,0]=4 35 B10R1.10 ClC1=CC(=CC=C1)C#CI RNI00103 [1,0,0,0,0,0|1,0,2]=4 36 B10R1.10 FC1=CC=CC(=C1)CCBr CDS000178 [1,0,0,0,0,0|1,1,0]=3 37 B10R1.10 NNCC1=CC(=CC=C1)F PHB00030 [1,0,0,0,0,0|1,1,0]=3 38 B10R1.10 NNCC1=CC=CC(=C1)Cl CBR00830 [1,0,0,0,0,0|1,0,0]=2 39 B10R1.10 O/N=C\C1=CC(=CC=C1)Cl L169935 [1,0,0,0,0,0|1,0,2]=4 40 B10R1.10 O=CCC1=CC(=CC=C1)Cl CDS007911 [1,0,0,0,0,0|1,0,1]=3 41 B10R1.10 O=CNC1=CC=CC(=C1)Cl PH000062 [1,0,0,0,0,0|2,0,1]=4 42 B10R1.10 [C-]#[N+]CC1=CC=CC(=C1)Cl CDS008970 [1,0,0,0,0,0|0,0,2]=3 43 B10R1.17 BrCCNC1=CC=CC=C1 S374776 [1,0,0,0,0,0|3,0,0]=4 44 B10R1.17 BrCCSC1=CC=CC=C1 PH011242 [1,0,0,0,0,0|3,0,0]=4 45 B10R1.17 C(=C/SC1=CC=CC=C1)\C T281522 [1,0,0,0,0,0|2,0,1]=4 46 B10R1.17 C(=O)CSC1=CC=CC=C1 T216623 [1,0,0,0,0,0|3,0,0]=4 47 B10R1.17 C/C=C/SC1=CC=CC=C1 T282642 [1,0,0,0,0,0|2,0,1]=4 48 B10R1.17 C=CCSC1=CC=CC=C1 S614246 [1,0,0,0,0,0|2,0,1]=4 49 B10R1.17 CCCC[N+]1=CC=CC=C1 CDS000353 [1,0,0,0,0,0|2,0,0]=3 50 B10R1.17 CCNCC1=NC=CC=C1 CBR00044 [1,0,0,0,0,0|3,0,0]=4 51 B10R1.17 CNCCC1=CC=NC=C1 CDS007517 [1,0,0,0,0,0|1,0,0]=2 52 B10R1.17 CNCCC1=NC=CC=C1 R750492 [1,0,0,0,0,0|1,0,0]=2 53 B10R1.17 COCCC1=CC=NC=C1 PH007374 [1,0,0,0,0,0|2,0,0]=3 54 B10R1.17 CSC=CC1=CC=CC=C1 S332976 [1,0,0,0,0,0|1,0,2]=4 55 B10R1.17 CSCCC1=NC=CC=C1 PH007369 [1,0,0,0,0,0|2,0,0]=3 56 B10R1.17 ClCCCC1=CC=CC=N1 CDS021720 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.17 N#CCCC1=NC=CC=C1 CBR00364 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.17 N#CCNC1=CC=CC=C1 CDS003237 [1,0,0,0,0,0|3,0,0]=4 59 B10R1.17 NNCCC1=CC=CC=C1 CDS015167 [1,0,0,0,0,0|1,0,0]=2 60 B10R1.17 NNCCC1=CC=CN=C1 PH019024 [1,0,0,0,0,0|2,0,0]=3 61 B10R1.17 [C-]#[N+]CCC1=NC=CC=C1 PH015418 [1,0,0,0,0,0|1,0,2]=4 62 B10R1.17 [SiH3]CCCC1=CC=CC=C1 S833584 [1,0,0,0,0,0|1,1,0]=3 63 B12R1.17 C=CCC(N)C1=CC=CC(=C1)Cl PH015654 [0,1,0,0,0,0|1,0,1]=3 64 B12R1.17 C=CCC(O)C1=CC=CC(=C1)Br PH018221 [0,1,0,0,0,0|1,1,1]=4 65 B12R1.17 CCCC(O)C1=C[N+](=CC=C1)[O-] S668400 [0,1,0,0,0,0|3,0,0]=4 66 B12R1.17 CNC[C@H](O)C1=CC(=CC=C1)O CDS000481 [0,1,0,0,0,0|1,0,0]=2 67 B12R1.28 CC1=CC(=CC=C1)OCCC#N PH001328 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.28 CC1=CC(=CC=C1)OCCNN PH019453 [0,1,0,0,0,0|2,0,0]=3 69 B12R1.28 CC1=CC(=CC=C1)SCCCCl S799289 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.28 CC1=CC=CC(=C1)OCCCBr PH000366 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.28 CCCCOC1=CC=CC(=C1)N CBR00368 [0,1,0,0,0,0|2,0,0]=3 72 B12R1.28 CCCCOC1=CC=CC(=C1)O PH015345 [0,1,0,0,0,0|2,0,0]=3 73 B12R1.28 CCOCCC1=CC=CC(=N1)C S361399 [0,1,0,0,0,0|3,0,0]=4 74 B12R1.28 COCCOC1=CC(=CC=C1)N CBR01420 [0,1,0,0,0,0|2,0,0]=3 75 B12R1.28 ClC1=CC(=CC=C1)OCCCBr PH000250 [0,1,0,0,0,0|2,0,0]=3 76 B12R1.28 N#CCCNC1=CC=CC(=C1)Cl S295124 [0,1,0,0,0,0|2,0,0]=3 77 B12R1.28 NCCCOC1=CC=CC(=C1)Cl CDS002045 [0,1,0,0,0,0|2,0,0]=3 78 B12R1.50 CCC(=O)NC1=CC(=CC=C1)Cl R131474 [0,1,0,0,0,0|2,0,1]=4 79 B12R1.50 CNC(=O)NC1=CC(=CC=C1)C S652741 [0,1,0,0,0,0|2,0,1]=4 80 B12R1.50 CNC(=O)NC1=CC=CC(=C1)Br S711292 [0,1,0,0,0,0|1,1,1]=4 81 B12R1.50 CNC(=O)NC1=CC=CC(=C1)Cl S611093 [0,1,0,0,0,0|1,0,1]=3 82 B12R1.50 CNC(=O)OC1=CC=CC(=C1)Cl PH009057 [0,1,0,0,0,0|1,0,1]=3 83 B12R1.50 CNC(=S)NC1=CC(=CC=C1)C PH010051 [0,1,0,0,0,0|2,0,1]=4 84 B12R1.50 CNC(=S)NC1=CC=CC(=C1)F S913731 [0,1,0,0,0,0|1,1,1]=4 85 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl S594326 [0,1,0,0,0,0|2,0,1]=4 86 B12R1.50 O=C(NO)NC1=CC(=CC=C1)Cl R631787 [0,1,0,0,0,0|2,0,1]=4 87 B12R1.50 O=C(NO)NC1=CC(=CC=C1)Cl S652261 [0,1,0,0,0,0|2,0,1]=4 88 B12R1.226 CC(=O)COC1=CC=CC(=C1)Br OTV000350 [0,1,0,0,0,0|2,1,0]=4 89 B12R1.226 CC(=O)NNC1=CC=CC(=C1)Cl PH007201 [0,1,0,0,0,0|3,0,0]=4 90 B12R1.226 N=C(N)COC1=CC=CC(=C1)Cl CBR01127 [0,1,0,0,0,0|3,0,0]=4 91 B12R1.226 N=C(N)SCC1=CC(=CC=C1)Cl S533416 [0,1,0,0,0,0|3,0,0]=4 92 B12R1.226 NC1=CC(=CC=C1)CCC(=O)O CDS000895 [0,1,0,0,0,0|3,0,0]=4 93 B12R1.226 O=C(O)CCC1=CC=CC(=C1)O PH011597 [0,1,0,0,0,0|3,0,0]=4 94 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl L449121 [0,1,0,0,0,0|3,0,0]=4 95 B12R1.374 CC1=CC=C(C(=C1)CCNN)C PH019452 [0,1,0,0,0,0|2,0,0]=3 96 B12R1.374 CCCOC1=CC(=CC=C1N)C CDS012021 [0,1,0,0,0,0|3,0,0]=4 97 B12R1.374 CSCSC1=CC(=CC=C1Cl)Cl S393622 [0,1,0,0,0,0|2,0,0]=3 98 B12R1.374 N#CCOC1=CC(=CC=C1Cl)Cl OTV000126 [0,1,0,0,0,0|3,0,0]=4 99 B12R1.382 CCCOC1=CC=CC(=C1)C=O CDS007421 [0,1,0,0,0,0|3,0,0]=4 100 B12R1.382 COC1=CC(=CC=C1)CCCN CBR01749 [0,1,0,0,0,0|3,0,0]=4 101 B12R1.382 COC1=CC(=CC=C1)CCCO PH016113 [0,1,0,0,0,0|3,0,0]=4 102 B12R1.382 COC1=CC=CC(=C1)CCNN PH019074 [0,1,0,0,0,0|2,0,0]=3 103 B12R1.382 COCC[N+]1=CC=CC(=C1)C#N S632376 [0,1,0,0,0,0|3,0,0]=4 104 B12R1.385 CCCCC1=CC(=C(C=C1)N)C CDS010548 [0,1,0,0,0,0|2,0,0]=3 105 B12R1.385 CCCOC1=CC=C(C(=C1)C)N CDS012022 [0,1,0,0,0,0|3,0,0]=4 106 B12R1.385 CCNCC1=CC(=C(C=C1)Cl)Cl PH010574 [0,1,0,0,0,0|2,0,0]=3 107 B12R1.385 CSCSC1=CC(=C(C=C1)Cl)Cl S393738 [0,1,0,0,0,0|2,0,0]=3 108 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 T263664 [0,0,0,1,0,0|1,1,0]=3 109 B12R2.24 BrC1=CC=C2CCNCC2=C1 CDS020020 [0,0,0,1,0,0|2,1,0]=4 110 B12R2.24 BrC1=CC=C2CNCCC2=C1 CDS010128 [0,0,0,1,0,0|0,1,0]=2 111 B12R2.24 CC1=CC2=C(CCCC2)N=C1 R279013 [0,0,0,1,0,0|3,0,0]=4 112 B12R2.24 CC1=CC=C2CCNCC2=C1 MNO000106 [0,0,0,1,0,0|3,0,0]=4 113 B12R2.24 ClC1=CC=C2CNCCC2=C1 CDS020263 [0,0,0,1,0,0|0,0,0]=1 114 B12R2.24 ClC1=CC=C2OCCNC2=C1 CDS016427 [0,0,0,1,0,0|3,0,0]=4 115 B12R2.24 ClC1=CC=C2OCCNC2=C1 VBP00272 [0,0,0,1,0,0|3,0,0]=4 116 B12R2.24 OC1=CC=C2CCCNC2=C1 CDS019987 [0,0,0,1,0,0|3,0,0]=4 117 B12R2.203 CN1N=CC2=CC=CC(=C12)Br SYX00127 [0,0,0,1,0,0|1,1,1]=4 118 B12R2.203 O=C1CCC2=C1C(=CC=C2)S T285455 [0,0,0,1,0,0|3,0,0]=4 119 B12R2.612 CC1=CC=C2C(=C1)CCC2N CDS003487 [0,0,0,1,0,0|3,0,0]=4 120 B12R2.612 CN1C=CC2=C1C=CC(=C2)N CDS014563 [0,0,0,1,0,0|1,0,2]=4 121 B12R2.612 CN1C=NC2=CC(=CC=C12)Br CDS023161 [0,0,0,1,0,0|1,1,1]=4 122 B12R2.612 CN1C=NC2=CC(=CN=C12)Cl ADE001227 [0,0,0,1,0,0|2,0,1]=4 123 B12R2.612 CN1N=NC2=C1C=CC(=C2)N CBR01799 [0,0,0,1,0,0|3,0,0]=4 124 B12R2.612 O=C1CCC2=C1C=CC(=C2)S T285463 [0,0,0,1,0,0|3,0,0]=4 125 B12R2.1081 BrC1=CC=CC2=C1CCCC2 CDS007742 [0,0,0,1,0,0|1,1,0]=3 126 B12R2.1081 CC1=CC=CC2=C1NCCC2 CDS013606 [0,0,0,1,0,0|3,0,0]=4 127 B12R2.1081 NC1=C2CCCNC2=CC=C1 PH003531 [0,0,0,1,0,0|3,0,0]=4 128 B12R2.1081 NC1=CC=CC2=C1CCCC2 T281816 [0,0,0,1,0,0|2,0,0]=3 129 B12R2.1081 OC1=CC=CC2=C1C=CCC2 PH008627 [0,0,0,1,0,0|2,0,1]=4 130 B12R2.1081 OC1=CC=CC2=C1NCCC2 CDS019675 [0,0,0,1,0,0|3,0,0]=4 131 B12R2.1081 OC1=NC=CC2=C1CCCC2 PH009108 [0,0,0,1,0,0|3,0,0]=4 132 B12R2.2313 ClC1=CC=CC(=C1)C2CNC2 CDS020411 [0,0,0,1,0,0|0,0,0]=1 133 B12R2.2313 NC1=CC(=CC=N1)C2CCC2 CDS019075 [0,0,0,1,0,0|3,0,0]=4 134 B10R1.29 CNCCC1=C(N=CS1)C PH016266 [0,0,0,0,1,0|3,0,0]=4 135 B10R1.29 CNCCN1C=CN=C1C PH019250 [0,0,0,0,1,0|3,0,0]=4 136 B9R1.2 CC1=CC=CC(=C1)CS PH011231 [2,0,0,0,0,0|2,0,0]=4 137 B9R1.2 CC1=CC=NC(=C1)CN CDS018220 [2,0,0,0,0,0|2,0,0]=4 138 B9R1.2 CCC1=CC(=NC=C1)Br CDS011534 [2,0,0,0,0,0|1,1,0]=4 139 B9R1.2 CCC1=CC(=NC=C1)N CDS001263 [2,0,0,0,0,0|2,0,0]=4 140 B9R1.2 CCC1=CC=CC(=C1)Br CDS013673 [2,0,0,0,0,0|0,1,0]=3 141 B9R1.2 CCC1=NC(=CC=C1)C S580031 [2,0,0,0,0,0|2,0,0]=4 142 B9R1.2 CNC1=CC(=CC=C1)N S604097 [2,0,0,0,0,0|1,0,0]=3 143 B9R1.2 COC1=CC=CC(=C1)N CDS000467 [2,0,0,0,0,0|2,0,0]=4 144 B9R1.2 COC1=CN=CC(=C1)Cl ADE000444 [2,0,0,0,0,0|2,0,0]=4 145 B9R1.2 CSC1=CC=CC(=C1)O KOB0118 [2,0,0,0,0,0|2,0,0]=4 146 B9R1.2 NCC1=CC(=CC=C1)O CDS016848 [2,0,0,0,0,0|1,0,0]=3 147 B9R1.2 NCC1=CC=CC(=N1)Br CDS015880 [2,0,0,0,0,0|1,1,0]=4 148 B9R1.2 NCC1=CN=CC(=C1)Br CDS005093 [2,0,0,0,0,0|1,1,0]=4 149 B9R1.2 NCC1=NC(=CC=C1)Br CDS009036 [2,0,0,0,0,0|1,1,0]=4 150 B9R1.2 NNC1=CC=CC(=N1)Cl SYX00272 [2,0,0,0,0,0|2,0,0]=4 151 B9R1.2 OCC1=CC(=CN=C1)Cl MNO000182 [2,0,0,0,0,0|2,0,0]=4 152 B9R1.2 OCC1=NC=CC(=C1)Cl ADE000344 [2,0,0,0,0,0|2,0,0]=4 153 B9R1.8 BrCCC1=CC=CN=C1 CDS024209 [2,0,0,0,0,0|2,0,0]=4 154 B9R1.8 CCCC1=CC=NC=C1 S573086 [2,0,0,0,0,0|1,0,0]=3 155 B9R1.8 CCOC1=CC=CC=N1 S442267 [2,0,0,0,0,0|2,0,0]=4 156 B9R1.8 CNCC1=NC=NC=C1 PH017743 [2,0,0,0,0,0|2,0,0]=4 157 B9R1.8 CNCC1=NC=NC=C1 PH019105 [2,0,0,0,0,0|2,0,0]=4 158 B9R1.8 CNNC1=CC=CC=C1 PH012261 [2,0,0,0,0,0|1,0,0]=3 159 B9R1.8 COCC1=CC=CC=N1 S363146 [2,0,0,0,0,0|2,0,0]=4 160 B9R1.8 Cl[Hg]CC1=CC=CC=C1 S810894 [2,0,0,0,0,0|2,0,0]=4 161 B9R1.8 I[Hg]CC1=CC=CC=C1 S838705 [2,0,0,0,0,0|2,0,0]=4 162 B9R1.8 NCCC1=CC=CN=C1 CDS003709 [2,0,0,0,0,0|1,0,0]=3 163 B9R1.8 NCCC1=CC=CN=C1 CDS022961 [2,0,0,0,0,0|1,0,0]=3 164 B9R1.8 NOCC1=CC=CC=C1 CDS001502 [2,0,0,0,0,0|1,0,0]=3 165 B9R1.8 OCCC1=CC=CN=C1 CDS008359 [2,0,0,0,0,0|2,0,0]=4 166 B9R1.8 OCC[N+]1=CC=CC=C1 T161055 [2,0,0,0,0,0|2,0,0]=4 167 B9R1.8 SCCC1=CC=CC=N1 CDS004787 [2,0,0,0,0,0|2,0,0]=4 168 B9R1.8 SCCC1=CC=NC=C1 CDS000260 [2,0,0,0,0,0|2,0,0]=4 169 B9R1.8 SCCC1=CC=NC=C1 CDS004770 [2,0,0,0,0,0|2,0,0]=4 170 B11R1.13 CC1=CC=CN(C1=O)CCN PH017777 [1,1,0,0,0,0|2,0,0]=4 171 B11R1.13 CCCC1=C(C(=CC=C1)C)O S405507 [1,1,0,0,0,0|1,0,0]=3 172 B11R1.13 NCCC1=CC=CC(=C1Cl)Cl L300195 [1,1,0,0,0,0|0,0,0]=2 173 B11R1.13 OCCC1=CC=CC(=C1F)Cl CDS022327 [1,1,0,0,0,0|1,0,0]=3 174 B11R1.23 CCC(=O)C1=CC=CC(=C1)C PH014761 [1,1,0,0,0,0|1,0,1]=4 175 B11R1.23 CCC(=O)C1=CC=CC(=C1)N PH011160 [1,1,0,0,0,0|1,0,1]=4 176 B11R1.23 CCC(=O)C1=CC=CC(=C1)O PH010905 [1,1,0,0,0,0|1,0,1]=4 177 B11R1.23 CCC(O)C1=NC(=CC=C1)N PH018486 [1,1,0,0,0,0|2,0,0]=4 178 B11R1.23 CC[C@@H](O)C1=CC(=CC=C1)F PH018824 [1,1,0,0,0,0|0,1,0]=3 179 B11R1.23 CC[C@H](O)C1=CC(=CC=C1)F PH018897 [1,1,0,0,0,0|0,1,0]=3 180 B11R1.23 CNC(=O)C1=CC(=CC=C1)N CDS003178 [1,1,0,0,0,0|1,0,1]=4 181 B11R1.23 CNC(=O)C1=CC(=CC=C1)O EME00408 [1,1,0,0,0,0|1,0,1]=4 182 B11R1.23 CNC(=O)C1=CC(=CC=N1)Cl CDS004290 [1,1,0,0,0,0|1,0,1]=4 183 B11R1.23 CNC(=O)C1=CC(=NC=C1)Cl CBR00287 [1,1,0,0,0,0|1,0,1]=4 184 B11R1.23 CNC(=O)C1=CC=CC(=C1)C PH007559 [1,1,0,0,0,0|1,0,1]=4 185 B11R1.23 CNC(=O)C1=CC=CC(=C1)Cl PH011022 [1,1,0,0,0,0|0,0,1]=3 186 B11R1.23 CNN(C)C1=CC=CC(=C1)Br PH012310 [1,1,0,0,0,0|1,1,0]=4 187 B11R1.23 NC(CF)C1=CC(=CC=C1)Br CVT00033 [1,1,0,0,0,0|1,1,0]=4 188 B11R1.23 NNC(=O)C1=CC=CC(=C1)Cl PH009753 [1,1,0,0,0,0|1,0,1]=4 189 B11R1.23 O=C(NO)C1=CC(=CC=C1)Cl PH010173 [1,1,0,0,0,0|1,0,1]=4 190 B11R1.23 OC1=CC=CC(=C1)C(CN)O TMT00167 [1,1,0,0,0,0|1,0,0]=3 191 B11R1.34 CC1=CC(=CC(=C1)CNN)C PH019430 [1,1,0,0,0,0|2,0,0]=4 192 B11R1.34 CCCC1=NC(=CC(=N1)Cl)Cl PH015513 [1,1,0,0,0,0|2,0,0]=4 193 B11R1.34 CCOC1=CC(=CC(=C1)C)C S798266 [1,1,0,0,0,0|2,0,0]=4 194 B11R1.34 N#CCC1=CC(=CC(=C1)Cl)Cl OTV000840 [1,1,0,0,0,0|0,0,2]=4 195 B11R1.157 CC(=O)CC1=CC(=CC=C1)C CDS017452 [1,1,0,0,0,0|1,0,1]=4 196 B11R1.157 CC(N)CC1=CC=CC(=C1)Br CDS022739 [1,1,0,0,0,0|0,1,0]=3 197 B11R1.157 CC1=CC(=CC=C1)NC(C)C S657476 [1,1,0,0,0,0|2,0,0]=4 198 B11R1.157 CC1=CC(=NC=C1)CC(C)O PH015436 [1,1,0,0,0,0|2,0,0]=4 199 B11R1.157 CC1=CC=CC(=N1)CC(C)O PH015426 [1,1,0,0,0,0|2,0,0]=4 200 B11R1.157 CN(N)CC1=CC=CC(=C1)Cl PH007608 [1,1,0,0,0,0|0,0,0]=2 201 B11R1.157 NC(=O)NC1=CC=CC(=C1)Cl S576476 [1,1,0,0,0,0|1,0,1]=4 202 B11R1.157 NC(=S)NC1=CC=CC(=C1)Cl S549614 [1,1,0,0,0,0|1,0,1]=4 203 B11R1.182 CC1=CC=C(C(=C1)CCN)O PH019198 [1,1,0,0,0,0|1,0,0]=3 204 B11R1.182 CC1=CC=C(C(=C1)CCO)C S347248 [1,1,0,0,0,0|2,0,0]=4 205 B11R1.182 CNCC1=CC(=CC=C1Cl)Cl PH016788 [1,1,0,0,0,0|0,0,0]=2 206 B11R1.182 CNCC1=CC(=CC=C1O)F CDS021392 [1,1,0,0,0,0|0,1,0]=3 207 B11R1.182 N#CCC1=CC(=CC=C1Cl)Cl R594105 [1,1,0,0,0,0|0,0,2]=4 208 B11R1.182 NCCC1=CC(=CC=C1F)F L300276 [1,1,0,0,0,0|0,1,0]=3 209 B11R1.182 NCCC1=CC(=CC=C1N)Cl PH018969 [1,1,0,0,0,0|0,0,0]=2 210 B11R1.182 NCCC1=CC(=CC=C1O)Cl PH019172 [1,1,0,0,0,0|0,0,0]=2 211 B11R1.189 CCNC1=CC(=CC=C1)CC PH012321 [1,1,0,0,0,0|2,0,0]=4 212 B11R1.189 COCC1=CC=CC(=C1)CBr CDS024084 [1,1,0,0,0,0|1,1,0]=4 213 B11R1.192 C/C=N/C1=CC(=C(C=C1)Cl)Cl R466204 [1,1,0,0,0,0|1,0,1]=4 214 B11R1.192 CC1=CC=C(C=C1C)CCN CDS003135 [1,1,0,0,0,0|1,0,0]=3 215 B11R1.192 CC1=CC=C(C=C1C)CON PH013762 [1,1,0,0,0,0|2,0,0]=4 216 B11R1.192 CCCC1=CC=C(C(=C1)N)O R703311 [1,1,0,0,0,0|1,0,0]=3 217 B11R1.192 CCC[N+]1=CC=C(C(=C1)C)C S635464 [1,1,0,0,0,0|2,0,0]=4 218 B11R1.192 CCOC1=CC=C(C(=C1)N)Cl PH004977 [1,1,0,0,0,0|2,0,0]=4 219 B11R1.192 CCOC1=CC=C(C(=C1)N)N CDS007491 [1,1,0,0,0,0|2,0,0]=4 220 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl PH010199 [1,1,0,0,0,0|0,0,0]=2 221 B11R1.192 OCCC1=CC(=C(C=C1)F)Cl CDS022215 [1,1,0,0,0,0|1,0,0]=3 222 B11R1.192 OCCC1=CC=C(C(=C1)Br)O S739227 [1,1,0,0,0,0|1,1,0]=4 223 B11R1.1 CC1=CC=C(C=C1)CCNN PH018986 [1,1,0,0,0,0|1,0,0]=3 224 B11R1.1 CCCCC1=CC=C(C=C1)Cl TMT00677 [1,1,0,0,0,0|1,0,0]=3 225 B11R1.1 CCCCC1=CC=C(C=C1)O CDS001507 [1,1,0,0,0,0|1,0,0]=3 226 B11R1.1 CCCSC1=CC=C(C=C1)C S832839 [1,1,0,0,0,0|2,0,0]=4 227 B11R1.1 CCCSC1=CC=C(C=C1)N CBR01435 [1,1,0,0,0,0|2,0,0]=4 228 B11R1.1 CCNCC1=CC=C(C=C1)Cl PH011023 [1,1,0,0,0,0|2,0,0]=4 229 B11R1.1 CSCSC1=CC=C(C=C1)C S592749 [1,1,0,0,0,0|2,0,0]=4 230 B11R1.1 N#CCCC1=CC=C(C=C1)O PH011727 [1,1,0,0,0,0|2,0,0]=4 231 B11R1.1 NCCCC1=CC=C(C=C1)F CDS009095 [1,1,0,0,0,0|2,0,0]=4 232 B11R1.1 NNCCC1=CC=C(C=C1)F PH019072 [1,1,0,0,0,0|1,0,0]=3 233 B11R1.1 O=CCCC1=CC=C(C=C1)F CDS022638 [1,1,0,0,0,0|2,0,0]=4 234 B11R1.1 O=CCCC1=CC=C(C=C1)O CDS022892 [1,1,0,0,0,0|2,0,0]=4 235 B11R1.1 OCCCC1=CC=C(C=C1)Cl CDS003137 [1,1,0,0,0,0|2,0,0]=4 236 B11R1.1 [C-]#[N+]CCC1=CC=C(C=C1)F PH015031 [1,1,0,0,0,0|0,0,2]=4 237 B11R1.16 CCCC(C)C1=CC=CC=C1 S570958 [1,1,0,0,0,0|1,0,0]=3 238 B11R1.16 CCCC(N)C1=CC=CC=C1 CBR00785 [1,1,0,0,0,0|1,0,0]=3 239 B11R1.16 CCCS(=O)C1=CC=CC=C1 S799858 [1,1,0,0,0,0|2,0,0]=4 240 B11R1.16 CN/N=C(\N)/C1=CC=CC=C1 S32353 [1,1,0,0,0,0|1,0,1]=4 241 B11R1.16 CNCC(C)C1=CC=CC=C1 CDS011312 [1,1,0,0,0,0|0,0,0]=2 242 B11R1.16 CNCC(O)C1=CC=CC=C1 R158259 [1,1,0,0,0,0|0,0,0]=2 243 B11R1.16 CNCC(O)C1=CC=CC=C1 S321761 [1,1,0,0,0,0|0,0,0]=2 244 B11R1.16 COCC(N)C1=NC=CC=C1 CBR02363 [1,1,0,0,0,0|2,0,0]=4 245 B11R1.16 COC[C@@H](N)C1=CC=CC=C1 CDS006581 [1,1,0,0,0,0|1,0,0]=3 246 B11R1.16 CSCC(=O)C1=CC=CC=C1 S834017 [1,1,0,0,0,0|1,0,1]=4 247 B11R1.16 ONCC(O)C1=CC=CC=C1 S662003 [1,1,0,0,0,0|1,0,0]=3 248 B11R1.17 C/C=C/CC1=CC=CC=C1O PH015920 [1,1,0,0,0,0|1,0,1]=4 249 B11R1.17 CCCCC1=C(C=CC=C1)N CDS000462 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.17 CCCOC1=CC=CC=C1N CDS014846 [1,1,0,0,0,0|2,0,0]=4 251 B11R1.17 CCCSC1=CC=CC=C1N PH000487 [1,1,0,0,0,0|2,0,0]=4 252 B11R1.17 COCCC1=CC=CC=C1Br S809608 [1,1,0,0,0,0|1,0,0]=3 253 B11R1.17 COCOC1=CC=CC=C1Br CBR01868 [1,1,0,0,0,0|2,0,0]=4 254 B11R1.17 NCCCC1=C(C=CC=C1)F CBR02360 [1,1,0,0,0,0|2,0,0]=4 255 B11R1.28 C#CCCCC1=CC=CC=C1 CDS001437 [1,1,0,0,0,0|1,0,1]=4 256 B11R1.28 C#CCOCC1=CC=CC=C1 T268720 [1,1,0,0,0,0|1,0,1]=4 257 B11R1.28 C/C=C/COC1=CC=CC=C1 S767832 [1,1,0,0,0,0|1,0,1]=4 258 B11R1.28 C/C=C/CSC1=CC=CC=C1 S746207 [1,1,0,0,0,0|1,0,1]=4 259 B11R1.28 C=CCNCC1=CC=CC=C1 ANV00005 [1,1,0,0,0,0|1,0,1]=4 260 B11R1.28 C=CCNCC1=CC=CC=C1 CBR01347 [1,1,0,0,0,0|1,0,1]=4 261 B11R1.28 CC#CCOC1=CC=CC=C1 PH009632 [1,1,0,0,0,0|1,0,1]=4 262 B11R1.28 CCC/C=C/C1=CC=CC=C1 S579645 [1,1,0,0,0,0|1,0,1]=4 263 B11R1.28 CCCCOC1=NC=CC=C1 S434299 [1,1,0,0,0,0|2,0,0]=4 264 B11R1.28 CCCN=CC1=CC=CC=C1 S376639 [1,1,0,0,0,0|1,0,1]=4 265 B11R1.28 CCNCCC1=CC=CC=N1 S361453 [1,1,0,0,0,0|1,0,0]=3 266 B11R1.28 CCNCCC1=CC=NC=C1 OTV000969 [1,1,0,0,0,0|1,0,0]=3 267 B11R1.28 CCOCCC1=CC=CC=N1 S361402 [1,1,0,0,0,0|2,0,0]=4 268 B11R1.28 CCOCCC1=CC=NC=C1 S368741 [1,1,0,0,0,0|2,0,0]=4 269 B11R1.28 CNCCCC1=CC=CC=C1 CDS006632 [1,1,0,0,0,0|0,0,0]=2 270 B11R1.28 COCCOC1=CC=CC=C1 S793000 [1,1,0,0,0,0|1,0,0]=3 271 B11R1.28 COCCSC1=CC=CC=C1 TMT00668 [1,1,0,0,0,0|1,0,0]=3 272 B11R1.28 CSCCOC1=CC=CC=C1 S697990 [1,1,0,0,0,0|1,0,0]=3 273 B11R1.28 ClCCCSC1=CC=CC=C1 S799211 [1,1,0,0,0,0|2,0,0]=4 274 B11R1.28 ClCCNCC1=CC=CC=C1 S377872 [1,1,0,0,0,0|2,0,0]=4 275 B11R1.28 N#CCOCC1=CC=CC=C1 S240400 [1,1,0,0,0,0|2,0,0]=4 276 B11R1.28 NCCCNC1=CC=CC=C1 CDS021448 [1,1,0,0,0,0|2,0,0]=4 277 B11R1.28 NCCCOC1=CC=CC=C1 PH010546 [1,1,0,0,0,0|2,0,0]=4 278 B11R1.28 NCCCOC1=CC=CC=C1 VBP00077 [1,1,0,0,0,0|2,0,0]=4 279 B11R1.28 NNCCCC1=CC=NC=C1 PH019436 [1,1,0,0,0,0|2,0,0]=4 280 B11R1.28 NNCCCC1=NC=CC=C1 PH019447 [1,1,0,0,0,0|2,0,0]=4 281 B11R1.28 NOCCOC1=CC=CC=C1 CDS015326 [1,1,0,0,0,0|2,0,0]=4 282 B11R1.28 O/N=C/CCC1=CC=CC=C1 PH009095 [1,1,0,0,0,0|1,0,1]=4 283 B11R1.28 OCCCSC1=CC=CC=C1 S799238 [1,1,0,0,0,0|2,0,0]=4 284 B11R1.40 CC(CC1=CC=CC=C1)NN PH000293 [1,1,0,0,0,0|1,0,0]=3 285 B11R1.40 CCC(C)NC1=CC=CC=C1 S372293 [1,1,0,0,0,0|2,0,0]=4 286 B11R1.40 CCN(C)CC1=CC=CC=C1 PH012025 [1,1,0,0,0,0|2,0,0]=4 287 B11R1.40 CNC(=S)NC1=CC=CC=C1 S615188 [1,1,0,0,0,0|1,0,1]=4 288 B11R1.40 CNC(C)CC1=NC=CC=C1 CBR00462 [1,1,0,0,0,0|1,0,0]=3 289 B11R1.40 COC(=N)CC1=CC=CC=C1 S671398 [1,1,0,0,0,0|1,0,1]=4 290 B11R1.40 OC(CCl)CC1=CC=CC=C1 S825743 [1,1,0,0,0,0|2,0,0]=4 291 B11R1.91 C=C(C)CNC1=CC=CC=C1 S352047 [1,1,0,0,0,0|2,0,0]=4 292 B11R1.91 C=C(C)CSC1=CC=CC=C1 S614203 [1,1,0,0,0,0|2,0,0]=4 293 B11R1.91 CC(=O)CSC1=CC=CC=C1 PH011676 [1,1,0,0,0,0|2,0,0]=4 294 B11R1.91 CC(C)CSC1=CC=CC=C1 T286885 [1,1,0,0,0,0|2,0,0]=4 295 B11R1.91 CC(C)NCC1=CC=CC=C1 S633151 [1,1,0,0,0,0|2,0,0]=4 296 B11R1.91 CC(C)NCC1=CC=CC=C1 S696668 [1,1,0,0,0,0|2,0,0]=4 297 B11R1.91 CC(C)OCC1=CC=CC=C1 T332682 [1,1,0,0,0,0|2,0,0]=4 298 B11R1.91 CC(N)CCC1=CC=CC=C1 S363766 [1,1,0,0,0,0|1,0,0]=3 299 B11R1.91 CC(N)COC1=CC=CC=C1 PH011886 [1,1,0,0,0,0|2,0,0]=4 300 B11R1.91 CN(C)/C=N/C1=CC=CC=C1 R428108 [1,1,0,0,0,0|1,0,1]=4 301 B11R1.91 CN(C)/C=N/C1=CC=CC=C1 S361119 [1,1,0,0,0,0|1,0,1]=4 302 B11R1.91 CN(C)CCC1=CC=NC=C1 PH000201 [1,1,0,0,0,0|1,0,0]=3 303 B11R1.91 CN(C)CCC1=CN=CC=N1 PH012649 [1,1,0,0,0,0|2,0,0]=4 304 B11R1.91 CN(C)CCC1=NC=CC=C1 PH000750 [1,1,0,0,0,0|1,0,0]=3 305 B11R1.91 CN(C)CCC1=NC=CC=C1 S456276 [1,1,0,0,0,0|1,0,0]=3 306 B11R1.91 CN(N)CCC1=CC=CC=C1 PH013245 [1,1,0,0,0,0|0,0,0]=2 307 B11R1.91 CN(O)CCC1=CC=NC=C1 PH008939 [1,1,0,0,0,0|1,0,0]=3 308 B11R1.91 CS(=O)CCC1=CC=CC=N1 PH013755 [1,1,0,0,0,0|2,0,0]=4 309 B13R1.147 CN(C)NC(=O)C1=CC=CC(=C1)Cl PH007551 [0,2,0,0,0,0|1,0,1]=4 310 B13R1.147 NC(CC(=O)O)C1=CC=CC(=C1)Cl PH006840 [0,2,0,0,0,0|2,0,0]=4 311 B13R1.460 CNCC(O)C1=CC(=CC=C1)OC PH009882 [0,2,0,0,0,0|1,0,0]=3 312 B13R1.466 CNCC(O)C1=CC(=C(C=C1)F)F PH015262 [0,2,0,0,0,0|0,1,0]=3 313 B13R1.40 CNC(=O)NC1=CC=CC(=C1Cl)Cl S623687 [0,2,0,0,0,0|1,0,1]=4 314 B13R1.6 CC1=CC(=CC=C1)OCCCCCl S363707 [0,2,0,0,0,0|2,0,0]=4 315 B13R1.6 CCNCCOC1=CC=CC(=C1)C PH012546 [0,2,0,0,0,0|1,0,0]=3 316 B13R1.6 CNCCCOC1=CC=CC(=C1)Cl CBR00243 [0,2,0,0,0,0|0,0,0]=2 317 B13R1.6 ClC1=CC(=CC=C1)OCCCCBr PH011043 [0,2,0,0,0,0|1,0,0]=3 318 B13R1.6 NCCCCOC1=CC=CC(=C1)O PH012980 [0,2,0,0,0,0|2,0,0]=4 319 B13R1.15 CNC(=O)COC1=CC(=CC=C1)Br EME00143 [0,2,0,0,0,0|0,1,1]=4 320 B13R1.20 CCNC(=O)NC1=CC=CC(=C1)Cl S623717 [0,2,0,0,0,0|1,0,1]=4 321 B13R1.149 CC1=CC=CC(=C1)OCCN(C)C PH012061 [0,2,0,0,0,0|1,0,0]=3 322 B13R1.666 CCCCOC1=CC=CC(=C1)C=O PH010584 [0,2,0,0,0,0|2,0,0]=4 323 B13R1.666 CNCCOC1=CC=CC(=C1)OC CBR00274 [0,2,0,0,0,0|1,0,0]=3 324 B13R1.666 COCCOC1=CC=CC(=C1)CN CDS022801 [0,2,0,0,0,0|2,0,0]=4 325 B13R1.669 CCCCOC1=CC=C(C(=C1)C)N CDS012609 [0,2,0,0,0,0|2,0,0]=4 326 B13R1.148 CC(=O)C(Cl)CC1=CC=CC(=C1)Cl S567183 [0,2,0,0,0,0|1,0,0]=3 327 B13R1.148 CN(C)C(=O)CC1=CC(=CC=C1)Cl PH008587 [0,2,0,0,0,0|0,0,1]=3 328 B13R1.148 CN(C)C(=O)NC1=CC(=CC=C1)Cl S590371 [0,2,0,0,0,0|1,0,1]=4 329 B13R1.148 O=C(O)C(Br)CC1=CC(=CC=C1)Cl L129844 [0,2,0,0,0,0|2,0,0]=4 330 B13R1.2872 CNC(=O)NC1=CC(=CC=C1C)Cl S611026 [0,2,0,0,0,0|1,0,1]=4 331 B13R1.2872 CNC(=O)NC1=CC(=CC=C1Cl)Cl S636495 [0,2,0,0,0,0|1,0,1]=4 332 B13R1.2874 CNC(=O)NC1=CC(=CC(=C1)Cl)Cl S698679 [0,2,0,0,0,0|1,0,1]=4 333 B13R1.2879 CCC(N)CC1=CC(=C(C=C1)C)O T340685 [0,2,0,0,0,0|2,0,0]=4 334 B13R1.2879 CNC(=O)NC1=CC=C(C(=C1)Cl)C S646725 [0,2,0,0,0,0|1,0,1]=4 335 B13R1.2879 CNC(=O)NC1=CC=C(C(=C1)Cl)Cl S613053 [0,2,0,0,0,0|1,0,1]=4 336 B13R1.2879 CNC(=O)OC1=CC=C(C(=C1)Cl)Cl S725323 [0,2,0,0,0,0|1,0,1]=4 337 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)Cl PH003559 [0,2,0,0,0,0|1,0,1]=4 338 B13R1.511 CN(C)CCC1=CC=C(C(=C1)O)O PH013462 [0,2,0,0,0,0|1,0,0]=3 339 B13R1.893 O=C(O)CCC1=CC(=CC=C1Cl)Cl JRD0472 [0,2,0,0,0,0|2,0,0]=4 340 B13R1.575 CCCCC1=CC(=C(C=C1)O)C=O ASX00136 [0,2,0,0,0,0|2,0,0]=4 341 B11R2.35 BrC1=CC=CC(=C1)C2CC2 MNO000086 [1,0,0,1,0,0|0,1,0]=3 342 B11R2.35 NC1=CC=CC(=C1)C2CC2 CDS022395 [1,0,0,1,0,0|1,0,0]=3 343 B11R2.36 BrC1=CC=C2CNCC2=C1 CDS019338 [1,0,0,1,0,0|0,1,0]=3 344 B11R2.36 CC1=CC2=C(C=C1)NCC2 CDS000231 [1,0,0,1,0,0|1,0,0]=3 345 B11R2.36 ClC1=CC2=C(C=C1)NCC2 CDS003126 [1,0,0,1,0,0|0,0,0]=2 346 B11R2.36 ClC1=CC=C2NN=CC2=C1 CDS006550 [1,0,0,1,0,0|1,0,1]=4 347 B11R2.36 ClC1=NC2=C(C=C1)CCC2 CBR01977 [1,0,0,1,0,0|1,0,0]=3 348 B11R2.36 FC1=CC2=C(C=C1)NCC2 CDS005250 [1,0,0,1,0,0|0,1,0]=3 349 B11R2.36 FC1=CC=C2CCNC2=C1 CDS008960 [1,0,0,1,0,0|1,1,0]=4 350 B11R2.36 IC1=CC=C2CCNC2=C1 CDS022471 [1,0,0,1,0,0|1,1,0]=4 351 B11R2.36 IC1=CC=C2OCCC2=C1 CDS003452 [1,0,0,1,0,0|1,1,0]=4 352 B11R2.36 IC1=CC=C2OCCC2=C1 SYX00284 [1,0,0,1,0,0|1,1,0]=4 353 B11R2.36 NC1=CC2=C(C=C1)CCC2 T167487 [1,0,0,1,0,0|1,0,0]=3 354 B11R2.36 NC1=CC=C2NCCC2=C1 CDS019734 [1,0,0,1,0,0|1,0,0]=3 355 B11R2.36 O=C1C=CC2=C(N1)CCC2 T327182 [1,0,0,1,0,0|2,0,0]=4 356 B11R2.20 C1=CC2=C(C=C1)CNCC2 R750530 [1,0,0,1,0,0|0,0,0]=2 357 B11R2.20 C1=CC=C2N=CNCC2=C1 PH008283 [1,0,0,1,0,0|1,0,1]=4 358 B11R2.239 C1=CC(=CC=N1)C2CNC2 PH019033 [1,0,0,1,0,0|1,0,0]=3 359 B11R2.239 C1=CC(=NN=C1)C2CNC2 PH019031 [1,0,0,1,0,0|2,0,0]=4 360 B11R2.239 C1=CC=C(C=C1)C2CCN2 CDS019224 [1,0,0,1,0,0|2,0,0]=4 361 B11R2.239 C1=CN=C(C=C1)C2CNC2 PH018991 [1,0,0,1,0,0|1,0,0]=3 362 B11R2.239 C1=CN=C(N=C1)C2CNC2 PH018956 [1,0,0,1,0,0|2,0,0]=4 363 B11R2.239 C1=CN=CC(=C1)C2CNC2 PH019032 [1,0,0,1,0,0|1,0,0]=3 364 B11R2.239 C1=NC=C(C=N1)C2CNC2 PH019030 [1,0,0,1,0,0|2,0,0]=4 365 B13R2.13 BrC1=CC=CC(=C1)N2CCCC2 CDS023882 [0,1,0,1,0,0|1,1,0]=4 366 B13R2.13 ClC1=CC=CC(=C1)C2CCNC2 CBR02308 [0,1,0,1,0,0|0,0,0]=2 367 B13R2.13 ClC1=CC=CC(=N1)N2CCCC2 T324396 [0,1,0,1,0,0|2,0,0]=4 368 B13R2.162 NC1CCCC2=CC=C(C=C12)O PH019049 [0,1,0,1,0,0|2,0,0]=4 369 B13R2.162 O=C1CCC2=C(C1)C(=CC=C2)Br PH014667 [0,1,0,1,0,0|1,1,0]=4 370 B13R2.162 O=C1CCC2=CC=CC(=C2C1)Cl PH014571 [0,1,0,1,0,0|1,0,0]=3 371 B13R2.162 O=C1CCCC2=CC=C(C=C12)Cl JRD0695 [0,1,0,1,0,0|1,0,1]=4 372 B13R2.3021 CC1=CC(=CC=C1)OC2CNC2 CBR02368 [0,1,0,1,0,0|1,0,0]=3 373 B13R2.3729 ClC1=CC2=C(C=C1)OCCNC2 CBR02460 [0,1,0,1,0,0|2,0,0]=4 374 B13R2.3729 FC1=CC2=C(C=C1)CNCCN2 CDS020985 [0,1,0,1,0,0|0,1,0]=3 375 B13R2.4818 O=C1CCNC2=CC=CC(=C12)Cl PH002869 [0,1,0,1,0,0|2,0,0]=4 376 B13R2.5179 CC1CCCC2=C1C=CC(=C2)O S956082 [0,1,0,1,0,0|2,0,0]=4 377 B13R2.5179 NC1=CC=CC2=C1CCC(C2)O PH012616 [0,1,0,1,0,0|2,0,0]=4 378 B13R2.5179 O=C1CCCC2=CC(=CC=C12)Cl JRD0960 [0,1,0,1,0,0|1,0,1]=4 379 B13R2.5331 BrC1=CC(=CC=C1)SCC2CC2 SYX00131 [0,1,0,1,0,0|1,1,0]=4 380 B13R2.5331 BrC1=CC=CC(=C1)OCC2CC2 CDS023759 [0,1,0,1,0,0|1,1,0]=4 381 B13R2.5331 CC1=CC(=CC=C1)OCC2CO2 PH011100 [0,1,0,1,0,0|2,0,0]=4 382 B13R2.5331 ClC1=CC(=CC=C1)CNC2CC2 CBR00952 [0,1,0,1,0,0|1,0,0]=3 383 B13R2.5331 FC1=CC(=CC=C1)OCC2CO2 PH014771 [0,1,0,1,0,0|1,1,0]=4 384 B13R2.5190 CC1=NC2=C(N1C)C=CC(=C2)Cl PH003360 [0,1,0,1,0,0|1,0,1]=4 385 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)Cl PH009430 [0,1,0,1,0,0|0,0,1]=3 386 B13R2.5190 CN1C(=O)CC2=C1C=CC(=C2)O PH010625 [0,1,0,1,0,0|1,0,1]=4 387 B13R2.5190 CN1C2=CC=C(C=C2N=C1Cl)Cl PH018771 [0,1,0,1,0,0|1,0,1]=4 388 B13R2.328 NC1=C2OCCCC2=CC(=C1)Cl PH008846 [0,1,0,1,0,0|2,0,0]=4 389 B13R2.3683 O=C1CCC2=CC(=CC=C2S1)Cl IDF00017 [0,1,0,1,0,0|2,0,0]=4 390 B13R2.371 NC1=C2CCCCC2=C(C=C1)O PH008517 [0,1,0,1,0,0|2,0,0]=4 391 B13R2.371 OC1=C2CCCCC2=C(C=C1)Br ANV00215 [0,1,0,1,0,0|1,1,0]=4 392 B13R2.371 OC1=CC=C(C2=C1NCCC2)Cl T312959 [0,1,0,1,0,0|2,0,0]=4 393 B13R2.57 COC1=CC2=C(C=C1)CNCC2 CDS005465 [0,1,0,1,0,0|1,0,0]=3 394 B13R2.57 COC1=CC=C2CNCCC2=C1 CDS002721 [0,1,0,1,0,0|1,0,0]=3 395 B13R2.1613 N#CC1=CC=CC2=C1CNCC2 CDS015935 [0,1,0,1,0,0|1,0,0]=3 396 B13R2.2130 CN1CCC2=CC(=CC=C12)C=O OTV000668 [0,1,0,1,0,0|1,0,0]=3 397 B13R2.2487 COC1=CC=CC(=C1)C2CNC2 CDS019555 [0,1,0,1,0,0|1,0,0]=3 398 B13R2.369 NC1=C(C=C2CCCCC2=C1)O R161217 [0,1,0,1,0,0|2,0,0]=4 399 B9R1.7 CCCC1=CC=C(O1)C L159743 [1,0,0,0,1,0|2,0,0]=4 400 B9R1.7 CNCC1=CC=C(O1)C CDS003835 [1,0,0,0,1,0|2,0,0]=4 401 B9R1.7 NCCN1C=C(C=N1)Cl CBR00104 [1,0,0,0,1,0|2,0,0]=4 402 B9R1.33 CC1=C(SC=C1)CCN CBR01050 [1,0,0,0,1,0|2,0,0]=4 403 B9R1.33 CN1C=CC=C1CCN CBR01483 [1,0,0,0,1,0|2,0,0]=4 404 B9R1.33 N(C)CC1=CC=CN1C T316350 [1,0,0,0,1,0|2,0,0]=4 405 B9R1.12 CCCCC1=CC=CO1 CDS001204 [1,0,0,0,1,0|2,0,0]=4 406 B9R1.12 CCCCC1=CC=CS1 CDS001487 [1,0,0,0,1,0|2,0,0]=4 407 B9R1.12 CNCCN1C=CN=C1 CBR02318 [1,0,0,0,1,0|2,0,0]=4