0 B12R1.21 CC(=CCC1=CC=C(C=C1)O)C S369632 [0,0,0,0,0,0|1,0,1]=2 1 B12R1.21 CC(=O)C=CC1=CC=C(C=C1)O S350656 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.21 CC(=O)CSC1=CC=C(C=C1)Br VBP00216 [0,0,0,0,0,0|4,0,0]=4 3 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Cl PH009464 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.21 CC(=O)OCC1=CC=C(C=C1)C S528498 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.21 CC(C)/N=C/C1=CC=C(C=C1)Cl PH008253 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.21 CC(C)CCC1=CC=C(C=C1)O S511803 [0,0,0,0,0,0|1,0,0]=1 7 B12R1.21 CC(C)COC1=CC=C(C=C1)N CDS008265 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.21 CC(C)NCC1=CC=C(C=C1)Cl PH011090 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.21 CC1=CC=C(C=C1)OCC(C)O PH015463 [0,0,0,0,0,0|4,0,0]=4 10 B12R1.21 CN(C)/C=N/C1=CC=C(C=N1)Br PH013307 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.21 CN(C)CCC1=CC=C(C=C1)O S452254 [0,0,0,0,0,0|0,0,0]=0 12 B12R1.21 CN(C)CSC1=CC=C(C=C1)Cl PH007326 [0,0,0,0,0,0|2,0,0]=2 13 B12R1.21 NC(=O)CCC1=CC=C(C=C1)O CDS020808 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.1 CC1=CC=C(C=C1)CCNN PH018986 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.1 CCCCC1=CC=C(C=C1)Cl TMT00677 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.1 CCCCC1=CC=C(C=C1)O CDS001507 [1,0,0,0,0,0|1,0,0]=2 17 B11R1.1 CCCSC1=CC=C(C=C1)C S832839 [1,0,0,0,0,0|3,0,0]=4 18 B11R1.1 CCCSC1=CC=C(C=C1)N CBR01435 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.1 CCNCC1=CC=C(C=C1)Cl PH011023 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.1 CSCSC1=CC=C(C=C1)C S592749 [1,0,0,0,0,0|3,0,0]=4 21 B11R1.1 N#CCCC1=CC=C(C=C1)O PH011727 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.1 N#CCNC1=CC=C(C=C1)O S136581 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.1 N#CCNC1=CC=C(C=C1)O S245933 [1,0,0,0,0,0|3,0,0]=4 24 B11R1.1 N#CCNC1=CC=C(C=C1)O S281433 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.1 NCCCC1=CC=C(C=C1)F CDS009095 [1,0,0,0,0,0|3,0,0]=4 26 B11R1.1 NCCOC1=CC=C(C=C1)O PH008478 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.1 NNCCC1=CC=C(C=C1)F PH019072 [1,0,0,0,0,0|2,0,0]=3 28 B11R1.1 O=CCCC1=CC=C(C=C1)F CDS022638 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.1 O=CCCC1=CC=C(C=C1)O CDS022892 [1,0,0,0,0,0|2,0,0]=3 30 B11R1.1 OCCCC1=CC=C(C=C1)Cl CDS003137 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.1 [C-]#[N+]CCC1=CC=C(C=C1)F PH015031 [1,0,0,0,0,0|1,0,2]=4 32 B11R1.91 C=C(C)CNC1=CC=CC=C1 S352047 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.91 C=C(C)CSC1=CC=CC=C1 S614203 [1,0,0,0,0,0|2,0,1]=4 34 B11R1.91 CC(=O)CSC1=CC=CC=C1 PH011676 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.91 CC(C)CSC1=CC=CC=C1 T286885 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.91 CC(C)N=CC1=CC=CC=C1 S376825 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.91 CC(C)NCC1=CC=CC=C1 S633151 [1,0,0,0,0,0|2,0,0]=3 38 B11R1.91 CC(C)NCC1=CC=CC=C1 S696668 [1,0,0,0,0,0|2,0,0]=3 39 B11R1.91 CC(C)NCC1=CC=CN=C1 CBR00082 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.91 CC(C)OCC1=CC=CC=C1 T332682 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.91 CC(N)CCC1=CC=CC=C1 S363766 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.91 CC(N)COC1=CC=CC=C1 PH011886 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.91 CN(C)/C=C/C1=CC=NC=C1 PH014856 [1,0,0,0,0,0|1,0,2]=4 44 B11R1.91 CN(C)/C=N/C1=CC=CC=C1 R428108 [1,0,0,0,0,0|1,0,1]=3 45 B11R1.91 CN(C)/C=N/C1=CC=CC=C1 S361119 [1,0,0,0,0,0|1,0,1]=3 46 B11R1.91 CN(C)CCC1=CC=NC=C1 PH000201 [1,0,0,0,0,0|1,0,0]=2 47 B11R1.91 CN(C)CCC1=CN=CC=N1 PH012649 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.91 CN(C)CCC1=NC=CC=C1 PH000750 [1,0,0,0,0,0|1,0,0]=2 49 B11R1.91 CN(C)CCC1=NC=CC=C1 S456276 [1,0,0,0,0,0|1,0,0]=2 50 B11R1.91 CN(N)CCC1=CC=CC=C1 PH013245 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.91 CN(O)CCC1=CC=NC=C1 PH008939 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.91 CS(=O)CCC1=CC=CC=N1 PH013755 [1,0,0,0,0,0|3,0,0]=4 53 B13R1.3 COC1=CC=C(C=C1)CCC(=O)Cl PH014654 [0,1,0,0,0,0|3,0,0]=4 54 B13R1.3 COC1=CC=C(C=C1)CCC(C)N PH009720 [0,1,0,0,0,0|2,0,0]=3 55 B13R1.14 CNC(C)COC1=CC=C(C=C1)O S397989 [0,1,0,0,0,0|2,0,0]=3 56 B13R1.132 CC(CC(=O)O)C1=CC=C(C=C1)O T135879 [0,1,0,0,0,0|3,0,0]=4 57 B13R1.132 CC(O)CC(=O)C1=CC=C(C=C1)O S563862 [0,1,0,0,0,0|2,0,1]=4 58 B13R1.133 CC(=O)C(Cl)CC1=CC=C(C=C1)Cl S567140 [0,1,0,0,0,0|3,0,0]=4 59 B13R1.133 CC(CC1=CC=C(C=C1)O)C(=O)O PH008203 [0,1,0,0,0,0|3,0,0]=4 60 B13R1.133 CC1=CC=C(C=C1)NC(=O)N(C)C S613215 [0,1,0,0,0,0|2,0,1]=4 61 B13R1.133 CC1=CC=C(C=C1)NC(=S)N(C)C S536393 [0,1,0,0,0,0|2,0,1]=4 62 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)Br CBR00435 [0,1,0,0,0,0|1,0,1]=3 63 B13R1.133 CN(C)C(=O)CC1=CC=C(C=C1)O CDS020902 [0,1,0,0,0,0|0,0,1]=2 64 B13R1.133 CN(C)C(=O)NC1=CC=C(C=C1)Br S597708 [0,1,0,0,0,0|2,0,1]=4 65 B13R1.133 CN(C)C(=O)NC1=CC=C(C=C1)F S601640 [0,1,0,0,0,0|2,0,1]=4 66 B13R1.133 CN(C)C(=O)NC1=CC=C(C=C1)I S905356 [0,1,0,0,0,0|2,0,1]=4 67 B13R1.133 CN(C)C(=O)SC1=CC=C(C=C1)Cl PH007504 [0,1,0,0,0,0|2,0,1]=4 68 B13R1.133 CN(C)C(=S)NC1=CC=C(C=C1)Cl S541206 [0,1,0,0,0,0|2,0,1]=4 69 B13R1.511 CN(C)CCC1=CC=C(C(=C1)O)O PH013462 [0,1,0,0,0,0|0,0,0]=1 70 B13R1.512 CC(C)(O)CCC1=CC=C(C=C1)O S350885 [0,1,0,0,0,0|1,0,0]=2 71 B13R1.512 CC1=CC=C(C=C1)NCC(C)(C)C PH010499 [0,1,0,0,0,0|3,0,0]=4 72 B13R2.3791 CC1=CC=C2CCC(C2=N1)(C)C T187674 [0,0,0,1,0,0|3,0,0]=4 73 B11R1.20 C=C(C)CC1=CC=C(C=C1)O PH007153 [0,0,0,0,1,0|1,0,1]=3 74 B11R1.20 CC(=CC1=CC=C(C=C1)Cl)C S428086 [0,0,0,0,1,0|2,0,1]=4 75 B11R1.20 CC(=O)CC1=CC=C(C=C1)Cl CDS004628 [0,0,0,0,1,0|3,0,0]=4 76 B11R1.20 CC(=O)CC1=CC=C(C=C1)O PH011294 [0,0,0,0,1,0|2,0,0]=3 77 B11R1.20 CC(C)OC1=CC=C(C=C1)Br S671118 [0,0,0,0,1,0|3,0,0]=4 78 B11R1.20 CC(C)OC1=CC=C(C=C1)N CDS002559 [0,0,0,0,1,0|3,0,0]=4 79 B11R1.20 CC(C)OC1=CC=C(C=C1)N PH011325 [0,0,0,0,1,0|3,0,0]=4 80 B11R1.20 CC(C)SC1=CC=C(C=C1)Cl PH000601 [0,0,0,0,1,0|3,0,0]=4 81 B11R1.20 CN(C)CC1=CC=C(C=C1)Br PH012027 [0,0,0,0,1,0|1,0,0]=2 82 B13R1.513 CC1=CC=C(C=C1)OCCN(C)C PH012060 [0,0,0,0,0,1|1,0,0]=2 83 B13R1.513 CC1=CC=C(C=C1)SCCC(C)C S832855 [0,0,0,0,0,1|2,0,0]=3 84 B13R1.513 CN(C)CCCC1=CC=C(C=C1)N CDS004275 [0,0,0,0,0,1|1,0,0]=2 85 B13R1.513 CN(C)CCOC1=CC=C(C=C1)Br PH000198 [0,0,0,0,0,1|1,0,0]=2 86 B13R1.513 CN(C)CCOC1=CC=C(C=C1)Cl PH012067 [0,0,0,0,0,1|1,0,0]=2 87 B10R1.1 CC1=CC=C(C=C1)CNN CBR00829 [2,0,0,0,0,0|2,0,0]=4 88 B10R1.1 CC1=NC=C(C=C1)CCN CDS023206 [2,0,0,0,0,0|2,0,0]=4 89 B10R1.1 CCCC1=CC=C(C=C1)Cl CDS002895 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.1 CCC[N+]1=CC=C(C=C1)C S635588 [2,0,0,0,0,0|2,0,0]=4 91 B10R1.1 CCNC1=CC=C(C=C1)Cl PH011437 [2,0,0,0,0,0|2,0,0]=4 92 B10R1.1 CCOC1=CC=C(C=C1)F S362093 [2,0,0,0,0,0|2,0,0]=4 93 B10R1.1 CCOC1=CC=C(C=C1)N S566292 [2,0,0,0,0,0|2,0,0]=4 94 B10R1.1 CCSC1=CC=C(C=C1)C S832812 [2,0,0,0,0,0|2,0,0]=4 95 B10R1.1 CCSC1=CC=C(C=C1)N CBR00879 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.1 CNCC1=CC=C(C=C1)C CDS014661 [2,0,0,0,0,0|1,0,0]=3 97 B10R1.1 CNCC1=CC=C(N=C1)Cl CBR01530 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.1 COCC1=CC=C(C=C1)O S392596 [2,0,0,0,0,0|1,0,0]=3 99 B10R1.1 CSCC1=CC=C(C=C1)Br EME00156 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.1 CSCC1=CC=C(C=C1)Cl S637947 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.1 FC1=CC=C(C=C1)CCCl CDS020717 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.1 NNCC1=CC=C(C=C1)F CBR00828 [2,0,0,0,0,0|2,0,0]=4 103 B10R1.17 CCCC[N+]1=CC=CC=C1 CDS000353 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.17 CNCCC1=CC=NC=C1 CDS007517 [2,0,0,0,0,0|1,0,0]=3 105 B10R1.17 CNCCC1=NC=CC=C1 R750492 [2,0,0,0,0,0|1,0,0]=3 106 B10R1.17 COCCC1=CC=NC=C1 PH007374 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.17 CSCCC1=NC=CC=C1 PH007369 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.17 NNCCC1=CC=CC=C1 CDS015167 [2,0,0,0,0,0|1,0,0]=3 109 B10R1.17 NNCCC1=CC=CN=C1 PH019024 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.17 [SiH3]CCCC1=CC=CC=C1 S833584 [2,0,0,0,0,0|1,1,0]=4 111 B12R1.1 CC1=CC=C(C=C1)CCCCO JRD0946 [1,1,0,0,0,0|2,0,0]=4 112 B12R1.1 CC1=CC=C(C=C1)OCCNN PH019543 [1,1,0,0,0,0|2,0,0]=4 113 B12R1.1 CCCCOC1=CC=C(C=C1)Br PH014759 [1,1,0,0,0,0|2,0,0]=4 114 B12R1.1 CCCCSC1=CC=C(C=C1)C S799149 [1,1,0,0,0,0|2,0,0]=4 115 B12R1.1 CCCNCC1=CC=C(C=C1)Cl PH010169 [1,1,0,0,0,0|2,0,0]=4 116 B12R1.1 CNCCOC1=CC=C(C=C1)C PH012059 [1,1,0,0,0,0|1,0,0]=3 117 B12R1.1 ClCNCNC1=CC=C(C=C1)I R433829 [1,1,0,0,0,0|2,0,0]=4 118 B12R1.1 O=CNCCC1=CC=C(C=C1)Br PH000598 [1,1,0,0,0,0|1,0,1]=4 119 B12R1.1 O=CNCCC1=CC=C(C=C1)O PH010511 [1,1,0,0,0,0|0,0,1]=3 120 B12R1.1 OCCCCC1=CC=C(C=C1)Br JRD0948 [1,1,0,0,0,0|2,0,0]=4 121 B12R1.1 OCCCCC1=CC=C(C=C1)Cl JRD0947 [1,1,0,0,0,0|2,0,0]=4 122 B12R1.1 OCCCCC1=CC=C(C=C1)F JRD0949 [1,1,0,0,0,0|2,0,0]=4 123 B12R1.16 CCCC(=O)C1=CC=C(C=C1)O S439789 [1,1,0,0,0,0|1,0,1]=4 124 B12R1.16 CCCC(O)C1=CC=C(C=C1)Br S431877 [1,1,0,0,0,0|2,0,0]=4 125 B12R1.16 CCCC(O)C1=CC=C(C=C1)C S446955 [1,1,0,0,0,0|2,0,0]=4 126 B12R1.16 CCCC(O)C1=CC=C(C=C1)Cl S418080 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.16 CCCC(O)C1=CC=C(C=C1)F S447226 [1,1,0,0,0,0|2,0,0]=4 128 B12R1.16 CNCC(O)C1=CC=C(C=C1)O S433233 [1,1,0,0,0,0|0,0,0]=2 129 B12R1.49 CNC(C)CC1=CC=C(C=C1)O S411558 [1,1,0,0,0,0|0,0,0]=2 130 B12R1.49 NC(CC1=CC=C(C=C1)O)N=O PH016710 [1,1,0,0,0,0|1,0,1]=4 131 B12R1.71 CCCCC1=CC=C(C=C1)CN CDS001572 [1,1,0,0,0,0|2,0,0]=4 132 B12R1.71 CCNCC1=CC=C(C=C1)OC PH009847 [1,1,0,0,0,0|2,0,0]=4 133 B12R1.71 [C-]#[N+]CCC1=CC=C(C=C1)OC PH015493 [1,1,0,0,0,0|0,0,2]=4 134 B12R1.385 CCCCC1=CC(=C(C=C1)N)C CDS010548 [1,1,0,0,0,0|2,0,0]=4 135 B12R1.27 CCC(=O)CCC1=CC=CC=C1 S570338 [1,1,0,0,0,0|2,0,0]=4 136 B12R1.27 O=C(CCl)CCC1=CC=CC=C1 PH016229 [1,1,0,0,0,0|2,0,0]=4 137 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 S889105 [1,1,0,0,0,0|0,0,1]=3 138 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 S579718 [1,1,0,0,0,0|1,0,1]=4 139 B12R1.43 CN(C)C(=O)OC1=CC=CC=C1 S364436 [1,1,0,0,0,0|1,0,1]=4 140 B12R1.43 CN(C)C(=S)NC1=CC=CC=C1 S347302 [1,1,0,0,0,0|1,0,1]=4 141 B12R1.107 C/C(=N/N(C)C)/C1=CC=CC=C1 S881090 [1,1,0,0,0,0|1,0,1]=4 142 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 S561150 [1,1,0,0,0,0|1,0,1]=4 143 B12R1.107 CC(CN(C)C)C1=CN=CC=N1 PH012696 [1,1,0,0,0,0|2,0,0]=4 144 B12R1.107 CC(CN(C)N)C1=CC=CC=C1 PH001335 [1,1,0,0,0,0|1,0,0]=3 145 B12R1.107 CN(C)CC(Cl)C1=CC=CC=C1 PH011871 [1,1,0,0,0,0|0,0,0]=2 146 B12R1.107 CN(C)CC(Cl)C1=CC=CC=C1 PH018832 [1,1,0,0,0,0|0,0,0]=2 147 B12R1.107 CN(C)C[C@@H](N)C1=CC=CC=C1 PH018728 [1,1,0,0,0,0|0,0,0]=2 148 B12R1.125 CC1=CC=CC=C1CNC(C)C CDS011840 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.891 CC(C)(C)OCC1=CC=CC=C1 S653853 [1,1,0,0,0,0|2,0,0]=4 150 B12R1.891 C[Si](Cl)(Cl)CCC1=CC=CC=C1 S585440 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.4 C#CC1=CC=C(C=C1)CC(C)C S683094 [0,1,0,0,1,0|2,0,0]=4 152 B12R1.4 C=CC1=CC=C(C=C1)CN(C)C TMT00671 [0,1,0,0,1,0|1,0,0]=3 153 B12R1.4 CC(C)CC1=CC=C(C=C1)C#N PH017291 [0,1,0,0,1,0|2,0,0]=4 154 B12R1.4 CC(C)CC1=CC=C(C=C1)C=O CDS000461 [0,1,0,0,1,0|1,0,1]=4 155 B12R1.4 CN(C)CC1=CC=C(C=C1)C#N S683116 [0,1,0,0,1,0|1,0,0]=3 156 B12R1.4 COC1=CC=C(C=C1)CN(C)N PH007521 [0,1,0,0,1,0|1,0,0]=3 157 B12R1.4 COC1=CC=C(C=C1)NC(C)C PH009967 [0,1,0,0,1,0|2,0,0]=4 158 B12R1.20 CC1=CC=C(C=C1)C(=O)N(C)C S886033 [0,1,0,0,1,0|1,0,1]=4 159 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)Br CDS003955 [0,1,0,0,1,0|1,0,1]=4 160 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)Cl L168815 [0,1,0,0,1,0|1,0,1]=4 161 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)I L168521 [0,1,0,0,1,0|1,0,1]=4 162 B12R1.20 CN(C)C(=O)C1=CC=C(C=C1)O CDS011629 [0,1,0,0,1,0|0,0,1]=3 163 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Cl R278378 [0,1,0,0,1,0|2,0,0]=4 164 B12R1.233 CN(N)CC1=CC=C(C=C1Cl)Cl PH001217 [0,1,0,0,1,0|2,0,0]=4 165 B14R1.4 C=C(C)COCC1=CC=C(C=C1)OC T268909 [0,1,0,0,0,1|1,0,1]=4 166 B14R1.4 CN(C)CCOC1=CC=C(C=C1)C=O PH009797 [0,1,0,0,0,1|0,0,1]=3 167 B14R1.4 CN(C)CCOC1=CC=C(C=C1)CN CDS006173 [0,1,0,0,0,1|1,0,0]=3 168 B14R1.4 COC1=CC=C(C=C1)NCCN(C)C PH009971 [0,1,0,0,0,1|0,0,0]=2 169 B14R1.4 COC1=CC=C(C=C1)OCCN(C)C PH012069 [0,1,0,0,0,1|0,0,0]=2 170 B14R1.678 CC(C)NCC(O)C1=CC=C(C=C1)Cl PH019357 [0,1,0,0,0,1|2,0,0]=4 171 B14R1.678 CC1=CC=C(C=C1)C(=O)CCN(C)C S935220 [0,1,0,0,0,1|1,0,0]=3 172 B14R1.678 CC1=CC=C(C=C1)C(O)CNC(C)C CDS005316 [0,1,0,0,0,1|2,0,0]=4 173 B14R1.687 CN(C)/C=N/CC1=CC=C(C(=C1)Cl)Cl PH012921 [0,1,0,0,0,1|1,0,1]=4 174 B14R1.4464 CN(C)CCOC1=C(C=C(C=C1)Cl)Cl PH007335 [0,1,0,0,0,1|1,0,0]=3 175 B14R1.3 COC1=CC=C(C=C1)NC(=O)N(C)C S597627 [0,2,0,0,0,0|1,0,1]=4 176 B14R1.3 COC1=CC=C(C=C1)NC(=S)N(C)C S542784 [0,2,0,0,0,0|1,0,1]=4 177 B14R1.211 COC1=CC=C(C=C1)CC[N+](C)(C)C S425621 [0,2,0,0,0,0|0,0,1]=3 178 B14R1.211 COC1=CC=C(C=C1)OC[Si](C)(C)C T244899 [0,2,0,0,0,0|2,0,0]=4 179 B14R1.134 COC(=O)C(N)CC1=CC=C(C=C1)O S457787 [0,2,0,0,0,0|2,0,0]=4 180 B14R1.502 CCOC(=O)CCC1=CC=C(C=C1)O S582131 [0,2,0,0,0,0|2,0,0]=4 181 B14R1.685 CC(C)CC(=O)C1=CC=C(C(=C1)O)O PH008907 [0,2,0,0,0,0|1,0,1]=4 182 B14R1.15552 CC(=O)CCC1=CC(=C(C(=C1)C)O)C S290920 [0,2,0,0,0,0|2,0,0]=4 183 B12R1.127 CN(C)CC1=CC(=CC=C1Br)O CDS022289 [0,0,1,1,0,0|1,0,1]=4 184 B12R2.24 BrC1=CC2=C(C=C1)CCCC2 T263664 [1,0,0,1,0,0|2,0,0]=4 185 B12R2.24 BrC1=CC=C2CCNCC2=C1 CDS020020 [1,0,0,1,0,0|1,0,0]=3 186 B12R2.24 BrC1=CN=C2CCNCC2=C1 PHB00087 [1,0,0,1,0,0|2,0,0]=4 187 B12R2.24 CC1=CC=C2CCNCC2=C1 MNO000106 [1,0,0,1,0,0|1,0,0]=3 188 B12R2.24 OC1=CC=C2CCCNC2=C1 CDS019987 [1,0,0,1,0,0|2,0,0]=4 189 B12R2.2302 FC1=CC=C(C=C1)C2CNC2 CDS020373 [1,0,0,1,0,0|1,0,0]=3 190 B12R2.2057 C1=CC=C(C=C1)CNC2CC2 CDS004803 [1,0,0,1,0,0|2,0,0]=4 191 B12R2.606 CN1CC2=CC=C(C=C2C1)N CDS012772 [0,0,0,1,1,0|1,0,0]=3 192 B14R2.20 CC1=NNC(C1)C2=CC=C(C=C2)O S760544 [0,0,0,1,0,1|2,0,0]=4 193 B10R1.18 C=C(C)CC1=CC=CC=C1 PH015451 [1,0,0,0,1,0|1,0,1]=4 194 B10R1.18 CN(C)CC1=CC=CC=C1 S503916 [1,0,0,0,1,0|0,0,0]=2 195 B10R1.18 CN(C)CC1=CC=CC=C1 S942987 [1,0,0,0,1,0|0,0,0]=2 196 B10R1.18 CN(C)CC1=CC=CC=N1 S360821 [1,0,0,0,1,0|1,0,0]=3 197 B10R1.18 CN(N)CC1=CC=CC=C1 PH000424 [1,0,0,0,1,0|1,0,0]=3 198 B10R1.13 CC(C)C1=CC=C(C=C1)F S362034 [0,0,0,0,2,0|2,0,0]=4 199 B10R1.13 CC(C)C1=CC=C(C=C1)S R262188 [0,0,0,0,2,0|1,1,0]=4 200 B10R1.13 CN(C)C1=CC=C(C=C1)S CDS006116 [0,0,0,0,2,0|0,1,0]=3 201 B10R1.13 CN(C)C1=NC=C(C=C1)Br SYX00280 [0,0,0,0,2,0|2,0,0]=4 202 B10R1.54 CC1=CC=C(O1)CN(C)C S508993 [0,0,0,0,2,0|2,0,0]=4 203 B12R1.252 CC(=CCOC1=CC=CC=C1)C S134643 [1,0,0,0,0,1|1,0,1]=4 204 B12R1.252 CC(=O)CCSC1=CC=CC=C1 S635030 [1,0,0,0,0,1|2,0,0]=4 205 B12R1.252 CC(=O)CSCC1=CC=CC=C1 S646199 [1,0,0,0,0,1|2,0,0]=4 206 B12R1.252 CC(=O)NCCC1=CC=CC=C1 S581887 [1,0,0,0,0,1|2,0,0]=4 207 B12R1.252 CC(C)CCNC1=CC=CC=C1 S705780 [1,0,0,0,0,1|1,0,0]=3 208 B12R1.252 CC(C)CNCC1=CC=CC=C1 CBR01593 [1,0,0,0,0,1|1,0,0]=3 209 B12R1.252 CC(C)NCCC1=CC=CC=N1 PH010347 [1,0,0,0,0,1|2,0,0]=4 210 B12R1.252 CC(O)CCCC1=CC=CC=C1 PH000677 [1,0,0,0,0,1|2,0,0]=4 211 B12R1.252 CC(O)CCSC1=CC=CC=C1 T233005 [1,0,0,0,0,1|2,0,0]=4 212 B12R1.252 CC(O)CNCC1=CC=CC=C1 PH009735 [1,0,0,0,0,1|2,0,0]=4 213 B12R1.252 CC(O)COCC1=CC=CC=C1 S376620 [1,0,0,0,0,1|2,0,0]=4 214 B12R1.252 CN(C)C/C=C/C1=CC=CC=C1 S933392 [1,0,0,0,0,1|0,0,1]=3 215 B12R1.252 C[C@H](O)CNCC1=CC=CC=C1 PH007995 [1,0,0,0,0,1|2,0,0]=4 216 B12R1.252 [SiH](C)(C)CCCC1=CC=CC=C1 S829870 [1,0,0,0,0,1|1,0,0]=3