0 B11R1.91 CC(=O)CCC1=CC=CC=C1 BBL011439 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.91 CC(O)C#CC1=CC=CC=C1 BBL028011 [0,0,0,0,0,0|1,0,3]=4 2 B11R1.91 NC(=O)NCC1=CC=CC=C1 BBL013146 [0,0,0,0,0,0|2,0,0]=2 3 B11R1.91 NC(=S)NNC1=CC=CC=C1 BBL010670 [0,0,0,0,0,0|3,1,0]=4 4 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 BBL011517 [0,0,0,0,0,0|1,0,0]=1 5 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 BBL011393 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.91 O=C(O)CCC1=CC=CC=C1 BBL011572 [0,0,0,0,0,0|2,0,0]=2 7 B11R1.91 O=C(O)CNC1=CC=CC=C1 BBL012003 [0,0,0,0,0,0|3,0,0]=3 8 B11R1.91 O=C(O)COC1=CC=CC=C1 BBL015276 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.91 O=C(O)COC1=CN=CC=C1 BBL009657 [0,0,0,0,0,0|4,0,0]=4 10 B11R1.91 O=C(O)CSC1=CC=CC=C1 BBL000591 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.91 O=C(O)CSC1=CC=NC=C1 BBL001462 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.91 O=C(O)CSC1=NC=CC=C1 BBL041076 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 BBL036895 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.17 BrCCCC1=CC=CC=C1 BBL027292 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.17 CCCNC1=CC=CC=C1 BBL012082 [1,0,0,0,0,0|2,0,1]=4 16 B10R1.17 CNCCC1=NC=CC=C1 BBL004908 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.17 S=C=NCC1=CC=CC=C1 BBL013129 [1,0,0,0,0,0|1,1,1]=4 18 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 BBL009822 [0,1,0,0,0,0|1,0,0]=2 19 B12R1.21 CC(=O)\C=C\C1=CC=[N+](C)C=C1 BBL028837 [0,1,0,0,0,0|2,0,1]=4 20 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 BBL025760 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.21 CC1=CC=C(OCC(=O)Cl)C=C1 BBL013466 [0,1,0,0,0,0|3,0,0]=4 22 B12R1.21 CC1=CC=C(OCC(=O)O)C=C1 BBL014127 [0,1,0,0,0,0|3,0,0]=4 23 B12R1.21 CC1=CC=C(SCC(=O)O)C=C1 BBL000595 [0,1,0,0,0,0|3,0,0]=4 24 B12R1.21 CC1=CC=C(\C=C\C(=O)Cl)C=C1 BBL015035 [0,1,0,0,0,0|2,0,1]=4 25 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 BBL037011 [0,1,0,0,0,0|2,0,1]=4 26 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 BBL012245 [0,1,0,0,0,0|3,0,0]=4 27 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BBL002117 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 BBL013866 [0,1,0,0,0,0|3,0,0]=4 29 B12R1.21 O=C(Cl)COC1=CC=C(Br)C=C1 BBL014864 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.21 O=C(Cl)COC1=CC=C(F)C=C1 BBL013921 [0,1,0,0,0,0|3,0,0]=4 31 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Br)C=C1 BBL015034 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.21 O=C(Cl)\C=C\C1=CC=C(F)C=C1 BBL015033 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 BBL025794 [0,1,0,0,0,0|2,0,0]=3 34 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 BBL012597 [0,1,0,0,0,0|2,0,0]=3 35 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 BBL008613 [0,1,0,0,0,0|3,0,0]=4 36 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 BBL007585 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.21 O=C(O)CSC1=CC=C(Cl)C=C1 BBL000180 [0,1,0,0,0,0|3,0,0]=4 38 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 BBL037328 [0,1,0,0,0,0|2,0,1]=4 39 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 BBL035954 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 BBL012226 [0,1,0,0,0,0|2,0,1]=4 41 B12R1.21 OC(=O)\C=C\C1=CC=C(Cl)C=C1 BBL036957 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.27 COC(=O)CNC1=CC=CC=C1 BBL034685 [0,1,0,0,0,0|2,0,0]=3 43 B12R1.27 NNC(=O)CCC1=CC=CC=C1 BBL015565 [0,1,0,0,0,0|2,0,0]=3 44 B12R1.27 NNC(=O)CNC1=CC=CC=C1 BBL023232 [0,1,0,0,0,0|3,0,0]=4 45 B12R1.27 NNC(=O)CSC1=CC=CC=C1 BBL025676 [0,1,0,0,0,0|3,0,0]=4 46 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 BBL034736 [0,1,0,0,0,0|0,0,0]=1 47 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl BBL013950 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O BBL002385 [0,1,0,0,0,0|3,0,0]=4 49 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 BBL013314 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O BBL036665 [0,1,0,0,0,0|3,0,0]=4 51 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 BBL005466 [0,1,0,0,0,0|3,0,0]=4 52 B12R1.107 CC(=O)CC(O)C1=NC=CC=C1 BBL028836 [0,1,0,0,0,0|2,0,0]=3 53 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 BBL005127 [0,1,0,0,0,0|2,0,0]=3 54 B12R1.125 CC1=C(NCC(=O)O)C=CC=C1 BBL038113 [0,1,0,0,0,0|3,0,0]=4 55 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 BBL023122 [0,1,0,0,0,0|3,0,0]=4 56 B12R1.125 CC1=CC=CC=C1OCC(=O)Cl BBL014862 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)Cl BBL015052 [0,1,0,0,0,0|2,0,1]=4 58 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)O BBL013455 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.125 NC(=S)NCC1=C(Cl)C=CC=C1 BBL031879 [0,1,0,0,0,0|2,1,0]=4 60 B12R1.125 O=C(Cl)COC1=C(Cl)C=CC=C1 BBL014866 [0,1,0,0,0,0|3,0,0]=4 61 B12R1.125 O=C(Cl)COC1=CC=CC=C1Br BBL014872 [0,1,0,0,0,0|3,0,0]=4 62 B12R1.125 O=C(Cl)COC1=CC=CC=C1F BBL014493 [0,1,0,0,0,0|3,0,0]=4 63 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1Br BBL015050 [0,1,0,0,0,0|2,0,1]=4 64 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1F BBL015047 [0,1,0,0,0,0|2,0,1]=4 65 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 BBL012110 [0,1,0,0,0,0|2,0,0]=3 66 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 BBL025641 [0,1,0,0,0,0|2,0,0]=3 67 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 BBL027394 [0,1,0,0,0,0|3,0,0]=4 68 B12R1.125 O=C(O)COC1=C(Br)C=CC=C1 BBL013547 [0,1,0,0,0,0|3,0,0]=4 69 B12R1.125 O=C(O)COC1=CC=CC=C1Cl BBL012541 [0,1,0,0,0,0|3,0,0]=4 70 B12R1.125 O=C(O)COC1=CC=CC=C1F BBL013906 [0,1,0,0,0,0|3,0,0]=4 71 B12R1.125 O=C(O)\C=C\C1=C(Br)C=CC=C1 BBL017155 [0,1,0,0,0,0|2,0,1]=4 72 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 BBL016304 [0,1,0,0,0,0|2,0,1]=4 73 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 BBL013048 [0,1,0,0,0,0|2,0,1]=4 74 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl BBL036324 [0,1,0,0,0,0|2,0,1]=4 75 B12R1.226 CC1=CC=CC(OCC(=O)Cl)=C1 BBL014168 [0,1,0,0,0,0|3,0,0]=4 76 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 BBL007979 [0,1,0,0,0,0|3,0,0]=4 77 B12R1.226 NC1=CC(OCC(=O)O)=CC=C1 BBL002631 [0,1,0,0,0,0|3,0,0]=4 78 B12R1.226 NC1=CC=CC(CCC(=O)[O-])=C1 BBL033495 [0,1,0,0,0,0|2,0,0]=3 79 B12R1.226 O=C(Cl)COC1=CC=CC(Br)=C1 BBL014964 [0,1,0,0,0,0|3,0,0]=4 80 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 BBL017173 [0,1,0,0,0,0|3,0,0]=4 81 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BBL034639 [0,1,0,0,0,0|2,0,1]=4 82 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 BBL013143 [0,1,0,0,0,0|2,0,1]=4 83 B12R1.891 CC(C)(O)CCC1=CC=CC=C1 BBL018826 [0,1,0,0,0,0|1,0,2]=4 84 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 BBL027621 [0,0,0,1,0,0|2,0,0]=3 85 B10R1.18 N=C(N)CC1=CC=CC=C1 BBL029167 [0,0,0,0,1,0|2,0,0]=3 86 B10R1.18 NC(=S)NC1=CC=CC=C1 BBL013021 [0,0,0,0,1,0|2,1,0]=4 87 B10R1.18 O=C(Cl)CC1=CC=CC=C1 BBL011387 [0,0,0,0,1,0|1,0,0]=2 88 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BBL011406 [0,0,0,0,1,0|1,0,0]=2 89 B10R1.18 O=C(O)CC1=CC=CN=C1 BBL001481 [0,0,0,0,1,0|2,0,0]=3 90 B10R1.66 CC(=O)CCC1=CC=CO1 BBL028608 [0,0,0,0,1,0|2,0,0]=3 91 B10R1.66 CC(=O)CCN1C=CC=N1 BBL037748 [0,0,0,0,1,0|3,0,0]=4 92 B10R1.66 O=C(O)CCC1=CC=CO1 BBL027515 [0,0,0,0,1,0|3,0,0]=4 93 B10R1.66 O=C(O)CCN1C=CC=C1 BBL008565 [0,0,0,0,1,0|3,0,0]=4 94 B12R1.252 CC(C)NCCC1=CC=CC=C1 BBL023458 [0,0,0,0,0,1|2,0,1]=4 95 B12R1.252 N(CC1=CC=CC=C1)CC(C)C BBL022517 [0,0,0,0,0,1|2,0,1]=4 96 B12R1.252 O=C(O)CCSC1=CC=CC=C1 BBL000175 [0,0,0,0,0,1|2,0,0]=3 97 B12R1.252 O=C(O)CSCC1=CC=CC=C1 BBL000319 [0,0,0,0,0,1|1,1,0]=3 98 B12R1.252 O=C([O-])\C=C\SC1=CC=CC=C1 BBL011032 [0,0,0,0,0,1|2,0,1]=4 99 B9R1.8 BrCCC1=CC=CC=C1 BBL027290 [2,0,0,0,0,0|1,0,1]=4 100 B9R1.8 CNCC1=NC=CC=C1 BBL029574 [2,0,0,0,0,0|2,0,0]=4 101 B9R1.8 COCC1=CC=CC=C1 BBL011461 [2,0,0,0,0,0|0,0,0]=2 102 B9R1.8 ClCCC1=CC=CC=C1 BBL027318 [2,0,0,0,0,0|1,0,1]=4 103 B9R1.8 NNCC1=CC=CC=C1 BBL029077 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.8 NOCC1=CC=CC=C1 BBL040921 [2,0,0,0,0,0|1,0,0]=3 105 B9R1.8 O=C=NC1=CC=CC=C1 BBL013184 [2,0,0,0,0,0|1,0,1]=4 106 B9R1.8 OCCC1=CC=CC=C1 BBL036905 [2,0,0,0,0,0|0,0,2]=4 107 B11R1.1 CCCCC1=CC=C(N)C=C1 BBL012657 [1,1,0,0,0,0|1,0,1]=4 108 B11R1.16 CCOC(=O)C1=CC=CC=C1 BBL010500 [1,1,0,0,0,0|0,0,2]=4 109 B11R1.28 CNCCOC1=CC=CC=C1 BBL028178 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.28 NCCNCC1=CC=CC=C1 BBL027980 [1,1,0,0,0,0|1,0,1]=4 111 B11R1.28 NCCOCC1=CC=CC=C1 BBL003434 [1,1,0,0,0,0|0,0,1]=3 112 B11R1.28 OCCNCC1=CC=CC=C1 BBL012101 [1,1,0,0,0,0|1,0,1]=4 113 B11R1.40 COC(=O)CC1=CC=CC=C1 BBL010506 [1,1,0,0,0,0|2,0,0]=4 114 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 BBL012658 [1,1,0,0,0,0|1,0,1]=4 115 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 BBL008068 [0,1,0,0,1,0|1,0,0]=3 116 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 BBL005229 [0,1,0,0,1,0|1,0,0]=3 117 B11R1.20 CC(C)OC1=CC=C(N)C=C1 BBL028078 [0,1,0,0,1,0|1,0,1]=4 118 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 BBL012281 [0,1,0,0,1,0|1,0,0]=3 119 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BBL018950 [0,1,0,0,1,0|1,0,0]=3 120 B11R1.20 NC1=CC=C(CC(O)=S)C=C1 BBL002831 [0,1,0,0,1,0|1,0,1]=4 121 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 BBL027456 [0,1,0,0,1,0|1,0,0]=3 122 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 BBL016492 [0,1,0,0,1,0|1,0,0]=3 123 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 BBL028097 [0,1,0,0,1,0|1,0,0]=3 124 B11R1.86 CC(=O)NC1=CC=CC=C1N BBL002386 [0,1,0,0,1,0|1,0,0]=3 125 B11R1.86 NC(=O)CC1=CC=CC=C1O BBL003575 [0,1,0,0,1,0|1,0,0]=3 126 B11R1.86 O=C(O)CN1C=CC=CC1=O BBL010063 [0,1,0,0,1,0|2,0,0]=4 127 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 BBL037290 [0,1,0,0,1,0|1,0,0]=3 128 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 BBL009447 [0,1,0,0,1,0|1,0,0]=3 129 B11R1.157 CC(C)OC1=CC=CC(N)=C1 BBL036331 [0,1,0,0,1,0|1,0,1]=4 130 B11R1.157 NC(=O)CC1=CC=CC(N)=C1 BBL032017 [0,1,0,0,1,0|1,0,0]=3 131 B11R1.157 NC(=O)NC1=CC=CC(O)=C1 BBL007869 [0,1,0,0,1,0|2,0,0]=4 132 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 BBL011462 [0,1,0,0,1,0|2,0,0]=4 133 B11R1.25 NCC(=O)NCC1=CC=CO1 BBL011189 [0,1,0,0,1,0|2,0,0]=4 134 B11R1.25 O=C(CCl)NCC1=CC=CO1 BBL008375 [0,1,0,0,1,0|2,0,0]=4 135 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 BBL010613 [0,1,0,0,0,1|2,0,0]=4 136 B13R1.149 CC1=CC=CC(CSCC(=O)O)=C1 BBL002111 [0,1,0,0,0,1|1,1,0]=4 137 B13R1.149 O=C(O)CSCC1=CC=CC(Cl)=C1 BBL005395 [0,1,0,0,0,1|1,1,0]=4 138 B13R1.158 CC1=C(CSCC(=O)O)C=CC=C1 BBL000513 [0,1,0,0,0,1|1,1,0]=4 139 B13R1.348 CN(CC(=O)O)CC1=CC=CC=C1 BBL008871 [0,1,0,0,0,1|2,0,0]=4 140 B13R1.351 CC(SCC1=CC=CC=C1)C(=O)O BBL000512 [0,1,0,0,0,1|1,1,0]=4 141 B13R1.513 CC1=CC=C(CSCC(=O)O)C=C1 BBL000503 [0,1,0,0,0,1|1,1,0]=4 142 B13R1.513 CC1=CC=C(SCCC(=O)O)C=C1 BBL002765 [0,1,0,0,0,1|2,0,0]=4 143 B13R1.513 O=C(O)CCSC1=CC=C(Cl)C=C1 BBL022671 [0,1,0,0,0,1|2,0,0]=4 144 B13R1.513 O=C(O)CNCC1=CC=C(Cl)C=C1 BBL030006 [0,1,0,0,0,1|2,0,0]=4 145 B13R1.513 O=C(O)CSCC1=CC=C(Cl)C=C1 BBL007211 [0,1,0,0,0,1|1,1,0]=4 146 B13R1.513 O=C(O)CSCC1=CC=C(F)C=C1 BBL000373 [0,1,0,0,0,1|1,1,0]=4 147 B13R1.718 COC(=O)CCNC1=CC=CC=C1 BBL009803 [0,1,0,0,0,1|1,0,0]=3 148 B13R1.718 NCC(=O)NCCC1=CC=CC=C1 BBL012982 [0,1,0,0,0,1|1,0,0]=3 149 B13R1.718 NNC(=O)CSCC1=CC=CC=C1 BBL017070 [0,1,0,0,0,1|1,1,0]=4 150 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 BBL009402 [0,1,0,0,0,1|1,0,0]=3 151 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 BBL002159 [0,2,0,0,0,0|2,0,0]=4 152 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 BBL027730 [0,2,0,0,0,0|1,0,0]=3 153 B13R1.3 COC1=CC=C(COC(C)=O)C=C1 BBL027940 [0,2,0,0,0,0|0,0,0]=2 154 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 BBL023617 [0,2,0,0,0,0|1,0,0]=3 155 B13R1.14 CNC(=O)\C=C\C1=CC=C(N)C=C1 BBL024599 [0,2,0,0,0,0|1,0,1]=4 156 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 BBL028749 [0,2,0,0,0,0|1,0,0]=3 157 B13R1.14 COC(=O)CNC1=CC=C(Cl)C=C1 BBL009680 [0,2,0,0,0,0|2,0,0]=4 158 B13R1.14 COC(=O)CNC1=CC=C(F)C=C1 BBL031851 [0,2,0,0,0,0|2,0,0]=4 159 B13R1.132 NC(CC(=O)O)C1=CC=C(Cl)C=C1 BBL005120 [0,2,0,0,0,0|2,0,0]=4 160 B13R1.132 NC(CC(=O)O)C1=CC=C(F)C=C1 BBL004561 [0,2,0,0,0,0|2,0,0]=4 161 B13R1.133 NC(CC1=CC=C(Cl)C=C1)C(=O)O BBL027391 [0,2,0,0,0,0|2,0,0]=4 162 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O BBL007890 [0,2,0,0,0,0|2,0,0]=4 163 B13R1.164 O=C(O)CCC1=CC=C(O)C=C1O BBL028276 [0,2,0,0,0,0|2,0,0]=4 164 B13R1.511 CC(=O)OCC1=CC(=O)C(O)=CO1 BBL036450 [0,2,0,0,0,0|1,0,0]=3 165 B13R1.511 O=C(O)CCC1=CC(O)=C(O)C=C1 BBL027403 [0,2,0,0,0,0|2,0,0]=4 166 B13R1.15 CNC(=O)CCC1=CC(N)=CC=C1 BBL022932 [0,2,0,0,0,0|1,0,0]=3 167 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 BBL035649 [0,2,0,0,0,0|1,0,0]=3 168 B13R1.42 CNCC(=O)NCC1=CC=CC=C1 BBL029662 [0,2,0,0,0,0|1,0,0]=3 169 B13R1.42 CNCC(=O)NCC1=CC=CN=C1 BBL031825 [0,2,0,0,0,0|2,0,0]=4 170 B13R1.42 CNCC(=O)NCC1=NC=CC=C1 BBL031632 [0,2,0,0,0,0|2,0,0]=4 171 B13R1.42 C\C(=C/C#N)CCC1=CC=CC=C1 BBL011672 [0,2,0,0,0,0|2,0,0]=4 172 B13R1.42 N#CCC(=O)NCC1=CC=NC=C1 BBL016521 [0,2,0,0,0,0|2,0,0]=4 173 B13R1.42 N#CCC(=O)NCC1=CN=CC=C1 BBL014106 [0,2,0,0,0,0|2,0,0]=4 174 B13R1.42 N#CCC(=O)NCC1=NC=CC=C1 BBL017206 [0,2,0,0,0,0|2,0,0]=4 175 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 BBL011279 [0,2,0,0,0,0|1,0,0]=3 176 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 BBL011269 [0,2,0,0,0,0|1,0,0]=3 177 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 BBL009783 [0,2,0,0,0,0|1,0,0]=3 178 B13R1.528 CNC(=O)CCC1=C(N)C=CC=C1 BBL022931 [0,2,0,0,0,0|1,0,0]=3 179 B13R1.528 CNC(=O)COC1=C(Br)C=CC=C1 BBL017817 [0,2,0,0,0,0|2,0,0]=4 180 B13R1.528 NNC(=O)CCC1=CC=CC=C1O BBL009239 [0,2,0,0,0,0|2,0,0]=4 181 B13R1.528 O=C(CCl)NCC1=CC=CC=C1F BBL017813 [0,2,0,0,0,0|1,0,0]=3 182 B13R1.152 NC(C(=O)O)C(O)C1=CC=CC=C1 BBL027465 [0,2,0,0,0,0|2,0,0]=4 183 B13R1.147 NC(CC(=O)O)C1=CC(Br)=CC=C1 BBL022136 [0,2,0,0,0,0|2,0,0]=4 184 B13R1.147 NC(CC(=O)O)C1=CC(F)=CC=C1 BBL008180 [0,2,0,0,0,0|2,0,0]=4 185 B13R1.147 NC(CC(=O)O)C1=CC(I)=CC=C1 BBL008176 [0,2,0,0,0,0|2,0,0]=4 186 B13R1.147 NC(CC(=O)O)C1=CC(O)=CC=C1 BBL012151 [0,2,0,0,0,0|2,0,0]=4 187 B13R1.147 NC(CC(=O)O)C1=CC=CC(Cl)=C1 BBL013290 [0,2,0,0,0,0|2,0,0]=4 188 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Br BBL008169 [0,2,0,0,0,0|2,0,0]=4 189 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Cl BBL013281 [0,2,0,0,0,0|2,0,0]=4 190 B13R1.347 CC(=O)CS(=O)(=O)C1=CC=CC=C1 BBL004239 [0,2,0,0,0,0|2,0,0]=4 191 B13R1.713 CNC(CC(=O)O)C1=CC=CC=C1 BBL025899 [0,2,0,0,0,0|2,0,0]=4 192 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 BBL000576 [0,2,0,0,0,0|2,0,0]=4 193 B11R2.10 O=C1NC2=C(C=CC=C2)O1 BBL027537 [0,0,0,1,1,0|1,0,0]=3 194 B13R2.155 NC1=CC=C2CCC(=O)NC2=C1 BBL008268 [0,1,0,1,0,0|2,0,0]=4 195 B13R2.155 O=C1CCC2=CC=C(O)C=C2N1 BBL011056 [0,1,0,1,0,0|2,0,0]=4 196 B13R2.369 NC1CC2=CC=CC=C2NC1=O BBL008284 [0,1,0,1,0,0|2,0,0]=4 197 B13R2.435 NC(=O)[C@@H]1CC2=CC=CC=C2N1 BBL011131 [0,1,0,1,0,0|2,0,0]=4 198 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 BBL009904 [0,1,0,1,0,0|1,0,1]=4 199 B9R1.6 CC(=O)C1=NC=CN=C1 BBL037027 [0,0,0,0,2,0|2,0,0]=4 200 B9R1.6 N=C(N)C1=CC=CC=C1 BBL012141 [0,0,0,0,2,0|2,0,0]=4 201 B9R1.6 O=C(Cl)C1=CC=CN=C1 BBL012969 [0,0,0,0,2,0|2,0,0]=4 202 B9R1.6 O=C(O)C1=CC=CN=C1 BBL037343 [0,0,0,0,2,0|2,0,0]=4 203 B9R1.6 O=C([O-])C1=NC=CC=C1 BBL033863 [0,0,0,0,2,0|2,0,0]=4 204 B9R1.6 [NH+]1=C(C(=O)Cl)C=CC=C1 BBL035642 [0,0,0,0,2,0|2,0,0]=4 205 B9R1.13 CC(=O)CN1C=CC=N1 BBL040015 [0,0,0,0,2,0|2,0,0]=4 206 B9R1.13 O=C(Cl)CC1=CC=CS1 BBL027527 [0,0,0,0,2,0|2,0,0]=4 207 B9R1.13 O=C(O)CC1=CSC=C1 BBL025878 [0,0,0,0,2,0|2,0,0]=4 208 B13R1.337 NC(=O)CCNCC1=CC=CC=C1 BBL023090 [0,0,0,0,0,2|2,0,0]=4 209 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 BBL022628 [0,0,0,0,0,2|1,1,0]=4