0 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [0,0,0,0,0,0|3,1,0]=4 1 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [0,0,0,0,0,0|1,1,0]=2 2 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [0,0,0,0,0,0|2,1,0]=3 3 B10R1.18 CC(=O)NC1=NC=NC=C1 Z1216844375 [0,0,0,0,0,0|3,1,0]=4 4 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.18 CC(C)NC1=CN=CC=C1 Z334882282 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [0,0,0,0,0,0|2,1,1]=4 10 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [0,0,0,0,0,0|2,0,0]=2 11 B10R1.18 N=C(N)CC1=CC=NC=C1 Z2441004470 [0,0,0,0,0,0|3,0,0]=3 12 B10R1.18 N=C(N)CC1=CN=CC=C1 Z2350941593 [0,0,0,0,0,0|3,0,0]=3 13 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [0,0,0,0,0,0|1,1,0]=2 14 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [0,0,0,0,0,0|2,1,0]=3 15 B10R1.18 NC(=O)CC1=CN=CN=C1 Z1203583458 [0,0,0,0,0,0|3,1,0]=4 16 B10R1.18 NC(=O)NC1=NC=CC=C1 Z208358454 [0,0,0,0,0,0|1,1,0]=2 17 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [0,0,0,0,0,0|1,1,0]=2 18 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [0,0,0,0,0,0|1,0,0]=1 19 B10R1.18 NC(=S)NC1=CC=CC=C1 Z57474172 [0,0,0,0,0,0|0,0,0]=0 20 B10R1.18 NC(=S)NC1=NC=CC=C1 Z57106231 [0,0,0,0,0,0|1,0,0]=1 21 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [0,0,0,0,0,0|3,1,0]=4 22 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [0,0,0,0,0,0|3,1,0]=4 23 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [0,0,0,0,0,0|3,1,0]=4 24 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [0,0,0,0,0,0|3,1,0]=4 25 B10R1.18 OB(O)CC1=CC=CC=C1 Z1147227831 [0,0,0,0,0,0|3,1,0]=4 26 B9R1.8 CCCC1=CC=CC=C1 Z104479154 [1,0,0,0,0,0|2,0,1]=4 27 B9R1.8 CCNC1=CC=CC=C1 Z104472482 [1,0,0,0,0,0|1,0,1]=3 28 B9R1.8 CCNC1=CC=NC=C1 Z359297730 [1,0,0,0,0,0|2,0,1]=4 29 B9R1.8 CCNC1=CN=CC=C1 Z334882416 [1,0,0,0,0,0|2,0,1]=4 30 B9R1.8 N#COC1=CC=CC=C1 Z1198165353 [1,0,0,0,0,0|1,0,2]=4 31 B9R1.8 NCCC1=CC=NC=C1 Z241056520 [1,0,0,0,0,0|2,0,1]=4 32 B9R1.8 NCCC1=CN=CC=C1 Z241056524 [1,0,0,0,0,0|2,0,1]=4 33 B9R1.8 NCCC1=NC=CC=C1 Z104478200 [1,0,0,0,0,0|2,0,1]=4 34 B9R1.8 NNCC1=CC=CC=C1 Z56969306 [1,0,0,0,0,0|2,0,0]=3 35 B9R1.8 NNCC1=CN=CC=C1 Z370706826 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.8 NOCC1=CC=CC=C1 Z90668722 [1,0,0,0,0,0|2,0,0]=3 37 B9R1.8 O=CCC1=CC=CC=C1 Z104472146 [1,0,0,0,0,0|1,1,0]=3 38 B9R1.8 OCCC1=CC=CC=C1 Z104473586 [1,0,0,0,0,0|1,1,1]=4 39 B9R1.8 S=C=NC1=CC=CC=C1 Z56904678 [1,0,0,0,0,0|0,0,2]=3 40 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [0,1,0,0,0,0|2,1,0]=4 41 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [0,1,0,0,0,0|1,1,0]=3 42 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [0,1,0,0,0,0|1,1,0]=3 43 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [0,1,0,0,0,0|1,1,0]=3 44 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [0,1,0,0,0,0|1,1,0]=3 45 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [0,1,0,0,0,0|1,1,0]=3 46 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [0,1,0,0,0,0|1,1,0]=3 47 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [0,1,0,0,0,0|1,1,0]=3 48 B11R1.20 CC(=O)NC1=NC=C(C=C1)Cl Z71484766 [0,1,0,0,0,0|2,1,0]=4 49 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [0,1,0,0,0,0|2,1,0]=4 50 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [0,1,0,0,0,0|1,0,0]=2 51 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [0,1,0,0,0,0|2,0,1]=4 53 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [0,1,0,0,0,0|2,0,0]=3 55 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [0,1,0,0,0,0|2,1,0]=4 56 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [0,1,0,0,0,0|0,1,0]=2 57 B11R1.20 CC1=CC=C(C=C1)NC(=S)N Z57965505 [0,1,0,0,0,0|0,0,0]=1 58 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [0,1,0,0,0,0|2,0,0]=3 60 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.20 N=C(N)NC1=CC=C(C=C1)Br Z5099116935 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.20 N=C(N)NC1=CC=C(C=C1)Cl Z2931635778 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.20 N=C(N)NC1=CC=C(C=C1)N Z2471157136 [0,1,0,0,0,0|1,0,0]=2 64 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [0,1,0,0,0,0|1,1,0]=3 65 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [0,1,0,0,0,0|1,1,0]=3 66 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [0,1,0,0,0,0|1,1,0]=3 67 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [0,1,0,0,0,0|1,1,0]=3 68 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [0,1,0,0,0,0|0,1,0]=2 69 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [0,1,0,0,0,0|0,1,0]=2 70 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [0,1,0,0,0,0|0,1,0]=2 71 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [0,1,0,0,0,0|0,1,0]=2 72 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [0,1,0,0,0,0|0,1,0]=2 73 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [0,1,0,0,0,0|1,0,0]=2 74 B11R1.20 NC(=S)NC1=CC=C(C=C1)Cl Z56939186 [0,1,0,0,0,0|0,0,0]=1 75 B11R1.20 NC(=S)NC1=CC=C(C=C1)F Z57455239 [0,1,0,0,0,0|0,0,0]=1 76 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [0,1,0,0,0,0|2,1,0]=4 77 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [0,1,0,0,0,0|2,1,0]=4 78 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [0,1,0,0,0,0|2,1,0]=4 79 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [0,1,0,0,0,0|2,1,0]=4 80 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [0,1,0,0,0,0|2,1,0]=4 81 B11R1.36 C=C(C(=O)O)C1=CC=CC=C1 Z1201618094 [0,1,0,0,0,0|2,1,0]=4 82 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 Z1255485389 [0,1,0,0,0,0|2,1,0]=4 83 B11R1.36 CC(=O)C(C)C1=CC=CC=C1 Z1255383314 [0,1,0,0,0,0|2,1,0]=4 84 B11R1.36 CC(=O)C(N)C1=CC=CC=C1 Z3234810419 [0,1,0,0,0,0|2,1,0]=4 85 B11R1.36 CC(=O)N(C)C1=CC=CC=C1 Z31506242 [0,1,0,0,0,0|1,1,0]=3 86 B11R1.36 CC(=O)N(C)C1=CC=NC=C1 Z1889797965 [0,1,0,0,0,0|2,1,0]=4 87 B11R1.36 CC(=O)N(C)C1=CN=CC=C1 Z1203252645 [0,1,0,0,0,0|2,1,0]=4 88 B11R1.36 CC(=O)N(C)C1=NC=CC=C1 Z223364322 [0,1,0,0,0,0|2,1,0]=4 89 B11R1.36 CC(C(=O)N)C1=CC=CC=C1 Z1255506457 [0,1,0,0,0,0|1,1,0]=3 90 B11R1.36 CC(N)C(C)C1=CC=CC=C1 Z1203578901 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.36 CN(C(=N)N)C1=CC=CC=C1 Z1269638527 [0,1,0,0,0,0|1,0,0]=2 92 B11R1.36 CN(C(=O)N)C1=CN=CC=C1 Z1188339188 [0,1,0,0,0,0|1,1,0]=3 93 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 Z57069256 [0,1,0,0,0,0|1,1,0]=3 94 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 Z57204607 [0,1,0,0,0,0|1,1,0]=3 95 B11R1.36 NC(=O)C(N)C1=NC=CC=C1 Z1251358507 [0,1,0,0,0,0|2,1,0]=4 96 B11R1.36 NC(C(=O)O)C1=CC=CC=C1 Z147647142 [0,1,0,0,0,0|2,1,0]=4 97 B11R1.36 N[C@@H](C(=O)O)C1=CC=CC=C1 Z278101784 [0,1,0,0,0,0|2,1,0]=4 98 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 Z957336528 [0,1,0,0,0,0|2,1,0]=4 99 B11R1.36 O=C(O)C(=O)C1=CC=CC=C1 Z381360894 [0,1,0,0,0,0|2,1,0]=4 100 B11R1.36 O=C(O)C(Cl)C1=CC=CC=C1 Z104495824 [0,1,0,0,0,0|2,1,0]=4 101 B11R1.36 O=C(O)C(F)C1=CC=CC=C1 Z1203161992 [0,1,0,0,0,0|2,1,0]=4 102 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 Z104473974 [0,1,0,0,0,0|2,1,0]=4 103 B11R1.36 O=C(O)C(S)C1=CC=CC=C1 Z808230894 [0,1,0,0,0,0|2,1,0]=4 104 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 Z1201618616 [0,1,0,0,0,0|2,1,0]=4 105 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 Z1255390767 [0,1,0,0,0,0|2,1,0]=4 106 B11R1.40 C#CC(=O)CC1=CC=CC=C1 Z1266856334 [0,1,0,0,0,0|2,1,0]=4 107 B11R1.40 C#CC(N)CC1=CC=CC=C1 Z4167757719 [0,1,0,0,0,0|2,0,1]=4 108 B11R1.40 C/C(=C\C1=CC=CC=C1)/C=O Z3219847417 [0,1,0,0,0,0|2,1,0]=4 109 B11R1.40 C=CC(=O)NC1=CC=CC=C1 Z440633536 [0,1,0,0,0,0|1,1,0]=3 110 B11R1.40 C=CC(=O)NC1=CN=CC=C1 Z440633590 [0,1,0,0,0,0|2,1,0]=4 111 B11R1.40 C=CC(=O)NC1=NC=CC=C1 Z440633578 [0,1,0,0,0,0|2,1,0]=4 112 B11R1.40 CC(CC1=CC=CC=C1)NN Z3033545382 [0,1,0,0,0,0|2,0,1]=4 113 B11R1.40 CC(CN)NC1=CC=CC=C1 Z1198235985 [0,1,0,0,0,0|1,0,1]=3 114 B11R1.40 CC(CN)OC1=CC=CC=C1 Z1245635737 [0,1,0,0,0,0|2,0,1]=4 115 B11R1.40 CC(CN)SC1=CC=CC=C1 Z844632804 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.40 CCC(N)CC1=CC=CC=C1 Z431980016 [0,1,0,0,0,0|2,0,1]=4 117 B11R1.40 CNC(=O)NC1=CC=CC=C1 Z55293754 [0,1,0,0,0,0|0,1,0]=2 118 B11R1.40 CNC(=S)NC1=CC=CC=C1 Z45796176 [0,1,0,0,0,0|0,0,0]=1 119 B11R1.40 CS/C(=N/C1=CC=CC=C1)/N Z107728768 [0,1,0,0,0,0|0,0,2]=3 120 B11R1.40 N/C(=N\O)/CC1=NC=CC=C1 Z285132826 [0,1,0,0,0,0|2,1,0]=4 121 B11R1.40 N=C(NN)NC1=CC=CC=C1 Z2768171754 [0,1,0,0,0,0|1,0,0]=2 122 B11R1.40 NC(CO)CC1=CC=CC=C1 Z234898263 [0,1,0,0,0,0|1,1,1]=4 123 B11R1.40 NCC(=O)CC1=CC=CC=C1 Z1569708978 [0,1,0,0,0,0|1,1,0]=3 124 B11R1.40 NCC(=O)NC1=CC=CC=C1 Z594413794 [0,1,0,0,0,0|0,1,0]=2 125 B11R1.40 NCC(=O)NC1=CC=NC=C1 Z1459449301 [0,1,0,0,0,0|1,1,0]=3 126 B11R1.40 NCC(=O)NC1=NC=CC=C1 Z1459449767 [0,1,0,0,0,0|1,1,0]=3 127 B11R1.40 NCC(F)CC1=CC=CC=C1 Z2740416678 [0,1,0,0,0,0|2,0,1]=4 128 B11R1.40 NCC(N)CC1=CC=CC=C1 Z425861056 [0,1,0,0,0,0|2,0,1]=4 129 B11R1.40 NCC(O)CC1=CC=CC=C1 Z419084966 [0,1,0,0,0,0|1,1,1]=4 130 B11R1.40 NNC(=O)CC1=CC=CC=C1 Z56867310 [0,1,0,0,0,0|1,1,0]=3 131 B11R1.40 NNC(=O)C[N+]1=CC=CC=C1 Z90123523 [0,1,0,0,0,0|2,1,0]=4 132 B11R1.40 NNC(=O)NC1=CC=CC=C1 Z56855648 [0,1,0,0,0,0|0,1,0]=2 133 B11R1.40 NNC(=O)NC1=NC=CC=C1 Z1171220858 [0,1,0,0,0,0|1,1,0]=3 134 B11R1.40 NNC(=S)NC1=CC=CC=C1 Z56836896 [0,1,0,0,0,0|0,0,0]=1 135 B11R1.40 NNC(=S)NC1=CN=CC=C1 Z56887664 [0,1,0,0,0,0|1,0,0]=2 136 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 Z1157651018 [0,1,0,0,0,0|1,1,1]=4 137 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 Z1741982891 [0,1,0,0,0,0|1,1,1]=4 138 B11R1.40 O=C(CCl)CC1=CC=CC=C1 Z164706024 [0,1,0,0,0,0|2,1,0]=4 139 B11R1.40 O=C(CCl)NC1=CC=CC=C1 Z56889119 [0,1,0,0,0,0|1,1,0]=3 140 B11R1.40 O=C(CCl)NC1=CC=NC=C1 Z2238905122 [0,1,0,0,0,0|2,1,0]=4 141 B11R1.40 O=C(CCl)NC1=CN=CC=C1 Z1558574655 [0,1,0,0,0,0|2,1,0]=4 142 B11R1.40 O=C(CCl)NC1=NC=CC=C1 Z2753743270 [0,1,0,0,0,0|2,1,0]=4 143 B11R1.40 O=C(CO)NC1=CC=CC=C1 Z228585444 [0,1,0,0,0,0|1,1,0]=3 144 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Br Z2312942099 [0,1,0,0,0,0|2,1,0]=4 145 B11R1.40 O=C/C(=C/C1=CC=CC=C1)/Cl Z104475950 [0,1,0,0,0,0|2,1,0]=4 146 B11R1.86 CC(=O)CC1=C(C=CC=C1)C Z329711570 [0,1,0,0,0,0|2,1,0]=4 147 B11R1.86 CC(=O)CC1=C(C=CC=C1)Cl Z329711556 [0,1,0,0,0,0|2,1,0]=4 148 B11R1.86 CC(=O)CC1=C(C=CC=C1)I Z1335657335 [0,1,0,0,0,0|2,1,0]=4 149 B11R1.86 CC(=O)CC1=C(C=CC=C1)O Z1198152110 [0,1,0,0,0,0|2,1,0]=4 150 B11R1.86 CC(=O)NC1=C(C=CC=C1)N Z239120544 [0,1,0,0,0,0|1,1,0]=3 151 B11R1.86 CC(=O)NC1=C(C=CC=C1)O Z57040482 [0,1,0,0,0,0|1,1,0]=3 152 B11R1.86 CC(=O)NC1=C(C=CC=N1)N Z1216821214 [0,1,0,0,0,0|2,1,0]=4 153 B11R1.86 CC(=O)NC1=C(C=NC=C1)C Z1148747945 [0,1,0,0,0,0|2,1,0]=4 154 B11R1.86 CC(=O)NC1=[N+](C=CC=C1)C Z56872112 [0,1,0,0,0,0|2,1,0]=4 155 B11R1.86 CC(=O)OC1=C(C=CC=C1)O Z1513803522 [0,1,0,0,0,0|2,1,0]=4 156 B11R1.86 CC(C)NC1=C(C=CC=C1)Br Z334939134 [0,1,0,0,0,0|2,0,1]=4 157 B11R1.86 CC(C)NC1=C(C=CC=C1)I Z362774390 [0,1,0,0,0,0|2,0,1]=4 158 B11R1.86 CC(N)CC1=C(C=CC=C1)Br Z1416200939 [0,1,0,0,0,0|2,0,1]=4 159 B11R1.86 CC(N)CC1=C(C=CC=C1)Cl Z415728108 [0,1,0,0,0,0|2,0,1]=4 160 B11R1.86 CC1=C(C=CC=C1)CC(=N)N Z1374778803 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.86 CC1=C(C=CC=C1)CC(=O)N Z52214433 [0,1,0,0,0,0|1,1,0]=3 162 B11R1.86 CC1=C(C=CC=C1)CC(=O)O Z104503424 [0,1,0,0,0,0|2,1,0]=4 163 B11R1.86 CC1=C(C=CC=C1)CC(C)N Z594038086 [0,1,0,0,0,0|2,0,1]=4 164 B11R1.86 CC1=C(C=CC=C1)NC(=S)N Z199467218 [0,1,0,0,0,0|0,0,0]=1 165 B11R1.86 CC1=C(C=CC=C1)NC(C)C Z267168760 [0,1,0,0,0,0|2,0,1]=4 166 B11R1.86 N=C(N)CC1=C(C=CC=C1)Br Z1742055055 [0,1,0,0,0,0|2,0,0]=3 167 B11R1.86 N=C(N)CC1=C(C=CC=C1)F Z1695738915 [0,1,0,0,0,0|2,0,0]=3 168 B11R1.86 NC(=O)CC1=C(C=CC=C1)Cl Z33547171 [0,1,0,0,0,0|1,1,0]=3 169 B11R1.86 NC(=O)CC1=C(C=CC=C1)F Z33546803 [0,1,0,0,0,0|1,1,0]=3 170 B11R1.86 NC(=O)CC1=C(C=CC=C1)N Z239125326 [0,1,0,0,0,0|1,1,0]=3 171 B11R1.86 NC(=O)CC1=C(C=CC=C1)O Z1255356155 [0,1,0,0,0,0|1,1,0]=3 172 B11R1.86 NC(=O)NC1=C(C=CC=C1)Br Z247615996 [0,1,0,0,0,0|0,1,0]=2 173 B11R1.86 NC(=O)NC1=C(C=CC=C1)Cl Z56754680 [0,1,0,0,0,0|0,1,0]=2 174 B11R1.86 NC(=O)NC1=C(C=CC=C1)F Z57028527 [0,1,0,0,0,0|0,1,0]=2 175 B11R1.86 NC(=S)NC1=C(C=CC=C1)F Z199467164 [0,1,0,0,0,0|0,0,0]=1 176 B11R1.86 O=C(O)CC1=C(C=CC=C1)Br Z285184626 [0,1,0,0,0,0|2,1,0]=4 177 B11R1.86 O=C(O)CC1=C(C=CC=C1)Cl Z56911957 [0,1,0,0,0,0|2,1,0]=4 178 B11R1.86 O=C(O)CC1=C(C=CC=C1)F Z104495526 [0,1,0,0,0,0|2,1,0]=4 179 B11R1.86 O=C(O)CC1=C(C=CC=C1)I Z1269196288 [0,1,0,0,0,0|2,1,0]=4 180 B11R1.86 O=C(O)CC1=C(C=CC=C1)O Z608061328 [0,1,0,0,0,0|2,1,0]=4 181 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [0,1,0,0,0,0|2,1,0]=4 182 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [0,1,0,0,0,0|2,1,0]=4 183 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [0,1,0,0,0,0|2,1,0]=4 184 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [0,1,0,0,0,0|1,1,0]=3 185 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [0,1,0,0,0,0|1,1,0]=3 186 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [0,1,0,0,0,0|1,1,0]=3 187 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [0,1,0,0,0,0|1,1,0]=3 188 B11R1.157 CC(=O)NC1=CC(=NC=C1)Cl Z1201619919 [0,1,0,0,0,0|2,1,0]=4 189 B11R1.157 CC(=O)NC1=C[N+](=CC=C1)C Z56760720 [0,1,0,0,0,0|2,1,0]=4 190 B11R1.157 CC(=O)NC1=NC(=CC=C1)C Z183992496 [0,1,0,0,0,0|2,1,0]=4 191 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [0,1,0,0,0,0|2,0,1]=4 192 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [0,1,0,0,0,0|2,0,1]=4 193 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [0,1,0,0,0,0|2,0,1]=4 194 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [0,1,0,0,0,0|2,0,1]=4 195 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [0,1,0,0,0,0|2,0,1]=4 196 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.157 CC1=CC(=CC=C1)NC(=N)N Z979503154 [0,1,0,0,0,0|1,0,0]=2 198 B11R1.157 CC1=CC(=CC=C1)NC(=S)N Z56921365 [0,1,0,0,0,0|0,0,0]=1 199 B11R1.157 C[N+]1=CC(=CC=C1)NC(=O)N Z56791760 [0,1,0,0,0,0|1,1,0]=3 200 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.157 N=C(N)NC1=CC(=CC=C1)Cl Z979503082 [0,1,0,0,0,0|1,0,0]=2 203 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [0,1,0,0,0,0|1,1,0]=3 204 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [0,1,0,0,0,0|1,1,0]=3 205 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [0,1,0,0,0,0|1,1,0]=3 206 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [0,1,0,0,0,0|0,1,0]=2 207 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [0,1,0,0,0,0|0,1,0]=2 208 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [0,1,0,0,0,0|0,1,0]=2 209 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [0,1,0,0,0,0|0,1,0]=2 210 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [0,1,0,0,0,0|0,1,0]=2 211 B11R1.157 NC(=S)NC1=CC(=CC=C1)Br Z111871258 [0,1,0,0,0,0|0,0,0]=1 212 B11R1.157 NC(=S)NC1=CC(=CC=C1)Cl Z199466968 [0,1,0,0,0,0|0,0,0]=1 213 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [0,1,0,0,0,0|0,0,0]=1 214 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [0,1,0,0,0,0|2,1,0]=4 215 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [0,1,0,0,0,0|2,1,0]=4 216 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [0,1,0,0,0,0|2,1,0]=4 217 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [0,1,0,0,0,0|2,1,0]=4 218 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [0,1,0,0,0,0|2,1,0]=4 219 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [0,1,0,0,0,0|2,1,0]=4 220 B11R1.509 NS(=O)(=O)CC1=CC=CC=C1 Z89268868 [0,1,0,0,0,0|2,1,0]=4 221 B11R1.509 NS(=O)(=O)NC1=CC=CC=C1 Z1425690842 [0,1,0,0,0,0|1,1,0]=3 222 B11R1.509 NS(=O)(=O)OC1=CC=CC=C1 Z1255360895 [0,1,0,0,0,0|2,1,0]=4 223 B11R2.4 N[C@@H]1C[C@@H]1C2=CC=CC=C2 Z2309888982 [0,0,0,1,0,0|2,0,1]=4 224 B11R2.4 N[C@@H]1C[C@H]1C2=CC=CC=C2 Z2296167800 [0,0,0,1,0,0|2,0,1]=4 225 B11R2.4 N[C@H]1C[C@@H]1C2=CC=CC=C2 Z2517097696 [0,0,0,1,0,0|2,0,1]=4 226 B11R2.10 BrC1=NC2=C(O1)C=CC=C2 Z733303132 [0,0,0,1,0,0|1,1,1]=4 227 B11R2.10 BrC1=NC2=C(S1)C=CC=C2 Z415645026 [0,0,0,1,0,0|1,0,2]=4 228 B11R2.10 CC1=CC2=C(N1)C=CC=N2 Z1255424933 [0,0,0,1,0,0|3,0,0]=4 229 B11R2.10 CC1=CC2=C(N1)C=CN=C2 Z1255388194 [0,0,0,1,0,0|3,0,0]=4 230 B11R2.10 CC1=CC2=C(N1)C=NC=C2 Z1198174139 [0,0,0,1,0,0|3,0,0]=4 231 B11R2.10 CC1=CC2=C(N1)N=CC=C2 Z1198180660 [0,0,0,1,0,0|3,0,0]=4 232 B11R2.10 CC1=CC2=C(O1)C=CC=C2 Z1255386706 [0,0,0,1,0,0|2,1,0]=4 233 B11R2.10 CC1=NC2=C(N1)C=CC=C2 Z55692894 [0,0,0,1,0,0|1,0,1]=3 234 B11R2.10 CC1=NC2=C(N1)N=CC=C2 Z857667464 [0,0,0,1,0,0|2,0,1]=4 235 B11R2.10 CC1=NC2=C(S1)C=CC=C2 Z2854344256 [0,0,0,1,0,0|1,0,2]=4 236 B11R2.10 CC1CC2=C(N1)C=CC=C2 Z104472410 [0,0,0,1,0,0|2,0,1]=4 237 B11R2.10 ClC1=NC2=C(N1)C=CC=C2 Z276129254 [0,0,0,1,0,0|1,0,1]=3 238 B11R2.10 ClC1=NC2=C(O1)C=CC=C2 Z235343929 [0,0,0,1,0,0|1,1,1]=4 239 B11R2.10 NC1=NC2=C(C1)C=CC=C2 Z2692198892 [0,0,0,1,0,0|1,0,1]=3 240 B11R2.10 NC1=NC2=C(N1)C=CC=C2 Z104378302 [0,0,0,1,0,0|1,0,0]=2 241 B11R2.10 NC1=NC2=C(N1)C=CC=N2 Z1436185321 [0,0,0,1,0,0|2,0,0]=3 242 B11R2.10 NC1=NC2=C(N1)C=CN=C2 Z1575082215 [0,0,0,1,0,0|2,0,0]=3 243 B11R2.10 NC1=NC2=C(O1)C=CC=C2 Z57069972 [0,0,0,1,0,0|0,1,1]=3 244 B11R2.10 NC1=NC2=C(O1)C=CC=N2 Z1198313417 [0,0,0,1,0,0|1,1,1]=4 245 B11R2.10 NC1=NC2=C(O1)C=CN=C2 Z1255498597 [0,0,0,1,0,0|1,1,1]=4 246 B11R2.10 NC1=NC2=C(O1)N=CC=C2 Z1255498595 [0,0,0,1,0,0|1,1,1]=4 247 B11R2.10 NC1=NC2=C(S1)C=CC=C2 Z56912586 [0,0,0,1,0,0|0,0,2]=3 248 B11R2.10 NC1=NC2=C(S1)C=CC=N2 Z1255491591 [0,0,0,1,0,0|1,0,2]=4 249 B11R2.10 NC1=NC2=C(S1)N=CC=C2 Z1198152308 [0,0,0,1,0,0|1,0,2]=4 250 B11R2.10 NC1=NC2=[N+](S1)C=CC=C2 Z1262632043 [0,0,0,1,0,0|1,0,2]=4 251 B11R2.10 NC1=NN2C=CC=CC2=C1 Z1203587619 [0,0,0,1,0,0|2,0,1]=4 252 B11R2.10 NC1=NN2C=CC=CC2=N1 Z1203578956 [0,0,0,1,0,0|2,0,1]=4 253 B11R2.10 NC1CC2=C(C1)C=CC=C2 Z1741971562 [0,0,0,1,0,0|2,0,1]=4 254 B11R2.10 O=C1CC2=C(C1)C=CC=C2 Z104486120 [0,0,0,1,0,0|2,1,0]=4 255 B11R2.10 O=C1CC2=C(N1)C=CC=C2 Z104478112 [0,0,0,1,0,0|1,1,0]=3 256 B11R2.10 O=C1CC2=C(N1)C=CC=N2 Z1198159859 [0,0,0,1,0,0|2,1,0]=4 257 B11R2.10 O=C1NC2=C(N1)C=CC=C2 Z56924489 [0,0,0,1,0,0|0,1,0]=2 258 B11R2.10 O=C1NC2=C(O1)C=CC=C2 Z56854468 [0,0,0,1,0,0|1,1,0]=3 259 B11R2.10 O=C1NC2=C(O1)C=CN=C2 Z1509173044 [0,0,0,1,0,0|2,1,0]=4 260 B11R2.10 O=C1NC2=C(S1)C=CC=C2 Z57728688 [0,0,0,1,0,0|1,0,1]=3 261 B11R2.10 S=C1SC2=C(S1)C=CC=C2 Z1198152357 [0,0,0,1,0,0|2,0,0]=3 262 B11R2.10 SC1=NC2=C(N1)C=CC=C2 Z203045044 [0,0,0,1,0,0|0,0,2]=3 263 B11R2.10 SC1=NC2=C(O1)C=CC=C2 Z104499134 [0,0,0,1,0,0|1,0,2]=4 264 B11R2.10 SC1=NC2=C(S1)C=CC=C2 Z104499140 [0,0,0,1,0,0|1,0,2]=4 265 B11R2.238 C1=CC=C(C=C1)NC2CC2 Z1203731288 [0,0,0,1,0,0|2,0,1]=4 266 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [0,0,0,0,1,0|1,1,0]=3 267 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [0,0,0,0,1,0|2,1,0]=4 268 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [0,0,0,0,1,0|2,1,0]=4 269 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [0,0,0,0,1,0|1,0,1]=3 270 B9R1.6 CC(N)C1=CN=CC=C1 Z85921957 [0,0,0,0,1,0|2,0,1]=4 271 B9R1.6 CC(N)C1=NC=CC=C1 Z56347059 [0,0,0,0,1,0|2,0,1]=4 272 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [0,0,0,0,1,0|1,1,1]=4 273 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [0,0,0,0,1,0|2,0,0]=3 274 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [0,0,0,0,1,0|1,0,1]=3 275 B9R1.6 C[C@@H](N)C1=CC=NC=C1 Z1197994836 [0,0,0,0,1,0|2,0,1]=4 276 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [0,0,0,0,1,0|1,1,1]=4 277 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [0,0,0,0,1,0|1,0,1]=3 278 B9R1.6 C[C@H](N)C1=CC=NC=C1 Z1492781304 [0,0,0,0,1,0|2,0,1]=4 279 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [0,0,0,0,1,0|1,1,1]=4 280 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [0,0,0,0,1,0|1,0,0]=2 281 B9R1.6 N=C(N)C1=CC=NC=C1 Z444349574 [0,0,0,0,1,0|2,0,0]=3 282 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [0,0,0,0,1,0|2,0,0]=3 283 B9R1.6 N=C(N)C1=CN=CN=C1 Z1741981975 [0,0,0,0,1,0|3,0,0]=4 284 B9R1.6 N=C(N)C1=NC=CC=C1 Z540728738 [0,0,0,0,1,0|2,0,0]=3 285 B9R1.6 N=C(N)C1=NC=CC=N1 Z992717154 [0,0,0,0,1,0|3,0,0]=4 286 B9R1.6 N=C(N)C1=NC=CN=C1 Z1741973428 [0,0,0,0,1,0|3,0,0]=4 287 B9R1.6 N=C(N)C1=NC=NC=C1 Z2582142457 [0,0,0,0,1,0|3,0,0]=4 288 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [0,0,0,0,1,0|1,1,0]=3 289 B9R1.6 NC(=O)C1=CN=NC=C1 Z1203579431 [0,0,0,0,1,0|2,1,0]=4 290 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [0,0,0,0,1,0|1,1,0]=3 291 B9R1.6 NC(=O)C1=NC=CC=N1 Z1198151945 [0,0,0,0,1,0|2,1,0]=4 292 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [0,0,0,0,1,0|2,1,0]=4 293 B9R1.6 NC(=O)C1=NC=NC=C1 Z1203579432 [0,0,0,0,1,0|2,1,0]=4 294 B9R1.6 NC(=O)C1=NN=CC=C1 Z1203580134 [0,0,0,0,1,0|2,1,0]=4 295 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [0,0,0,0,1,0|0,0,0]=1 296 B9R1.6 NC(=S)C1=CC=NC=C1 Z317055504 [0,0,0,0,1,0|1,0,0]=2 297 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [0,0,0,0,1,0|1,0,0]=2 298 B9R1.6 NC(=S)C1=NC=CC=C1 Z56956073 [0,0,0,0,1,0|1,0,0]=2 299 B9R1.6 NC(=S)C1=NC=CN=C1 Z234895463 [0,0,0,0,1,0|2,0,0]=3 300 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [0,0,0,0,1,0|1,1,0]=3 301 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [0,0,0,0,1,0|2,1,0]=4 302 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [0,0,0,0,1,0|2,1,0]=4 303 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [0,0,0,0,1,0|2,1,0]=4 304 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [0,0,0,0,1,0|2,1,0]=4 305 B9R1.6 OB(O)C1=CC=CC=C1 Z111782400 [0,0,0,0,1,0|2,1,0]=4 306 B9R1.13 CC(=O)NC1=CC=CS1 Z1198150448 [0,0,0,0,1,0|2,1,0]=4 307 B9R1.13 N=C(N)CC1=CC=CS1 Z1526503402 [0,0,0,0,1,0|3,0,0]=4 308 B9R1.13 NC(=O)CC1=CC=CN1 Z1203579730 [0,0,0,0,1,0|2,1,0]=4 309 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 Z2582847786 [0,0,0,0,0,1|2,1,0]=4 310 B11R1.91 CC(=O)CSC1=CC=CC=C1 Z19751394 [0,0,0,0,0,1|2,1,0]=4 311 B11R1.91 CC(=O)NCC1=CC=CC=C1 Z27749489 [0,0,0,0,0,1|1,1,0]=3 312 B11R1.91 CC(=O)NCC1=NC=CC=C1 Z324553036 [0,0,0,0,0,1|2,1,0]=4 313 B11R1.91 CC(=O)NNC1=CC=CC=C1 Z27767717 [0,0,0,0,0,1|1,1,0]=3 314 B11R1.91 CC(=O)OCC1=CC=CC=C1 Z19628364 [0,0,0,0,0,1|2,1,0]=4 315 B11R1.91 CC(C)CNC1=CC=CC=C1 Z2092369729 [0,0,0,0,0,1|2,0,1]=4 316 B11R1.91 CC(N)CCC1=CC=CC=C1 Z104476462 [0,0,0,0,0,1|2,0,1]=4 317 B11R1.91 CC(N)COC1=CC=CC=C1 Z600397650 [0,0,0,0,0,1|2,0,1]=4 318 B11R1.91 CC(O)CNC1=CC=CC=C1 Z234898271 [0,0,0,0,0,1|1,1,1]=4 319 B11R1.91 C[C@H](N)CCC1=CC=CC=C1 Z5044990030 [0,0,0,0,0,1|2,0,1]=4 320 B11R1.91 N=C(N)CCC1=CC=CC=C1 Z2092176896 [0,0,0,0,0,1|2,0,0]=3 321 B11R1.91 N=C(N)COC1=CC=CC=C1 Z1532540938 [0,0,0,0,0,1|2,0,0]=3 322 B11R1.91 N=C(N)CSC1=CC=CC=C1 Z1532718998 [0,0,0,0,0,1|2,0,0]=3 323 B11R1.91 N=C(N)NCC1=CC=NC=C1 Z2723680409 [0,0,0,0,0,1|2,0,0]=3 324 B11R1.91 N=C(N)NCC1=NC=CC=C1 Z911465258 [0,0,0,0,0,1|2,0,0]=3 325 B11R1.91 N=C(N)SCC1=CC=CC=C1 Z89242849 [0,0,0,0,0,1|2,0,0]=3 326 B11R1.91 NC(=O)/C=C/C1=CN=CC=C1 Z284112150 [0,0,0,0,0,1|2,1,0]=4 327 B11R1.91 NC(=O)CCC1=CC=CC=C1 Z33546514 [0,0,0,0,0,1|1,1,0]=3 328 B11R1.91 NC(=O)CCC1=CC=NC=C1 Z1095213378 [0,0,0,0,0,1|2,1,0]=4 329 B11R1.91 NC(=O)CNC1=CC=CC=C1 Z104583968 [0,0,0,0,0,1|0,1,0]=2 330 B11R1.91 NC(=O)COC1=CC=CC=C1 Z19735702 [0,0,0,0,0,1|1,1,0]=3 331 B11R1.91 NC(=O)COC1=CN=CC=C1 Z336080090 [0,0,0,0,0,1|2,1,0]=4 332 B11R1.91 NC(=O)CSC1=CC=CC=C1 Z19751390 [0,0,0,0,0,1|1,1,0]=3 333 B11R1.91 NC(=O)CSC1=CC=NC=C1 Z33546963 [0,0,0,0,0,1|2,1,0]=4 334 B11R1.91 NC(=O)NCC1=CC=CC=C1 Z104476310 [0,0,0,0,0,1|0,1,0]=2 335 B11R1.91 NC(=O)NCC1=CC=NC=C1 Z198194796 [0,0,0,0,0,1|1,1,0]=3 336 B11R1.91 NC(=O)NCC1=CN=CC=C1 Z57664442 [0,0,0,0,0,1|1,1,0]=3 337 B11R1.91 NC(=O)NCC1=NC=CC=C1 Z198194794 [0,0,0,0,0,1|1,1,0]=3 338 B11R1.91 NC(=O)OCC1=CC=CC=C1 Z33547079 [0,0,0,0,0,1|1,1,0]=3 339 B11R1.91 NC(=S)CCC1=CC=CC=C1 Z56824950 [0,0,0,0,0,1|1,0,0]=2 340 B11R1.91 NC(=S)COC1=CC=CC=C1 Z108595128 [0,0,0,0,0,1|1,0,0]=2 341 B11R1.91 NC(=S)NCC1=CC=CC=C1 Z56900892 [0,0,0,0,0,1|0,0,0]=1 342 B11R1.91 NC(=S)NNC1=CC=CC=C1 Z104483868 [0,0,0,0,0,1|0,0,0]=1 343 B11R1.91 O=C(O)/C=C/C1=CC=CC=C1 Z104474406 [0,0,0,0,0,1|2,1,0]=4 344 B11R1.91 O=C(O)C#CC1=CC=CC=C1 Z271128592 [0,0,0,0,0,1|2,1,0]=4 345 B11R1.91 O=C(O)CCC1=CC=CC=C1 Z57127332 [0,0,0,0,0,1|2,1,0]=4 346 B11R1.91 O=C(O)CNC1=CC=CC=C1 Z104496210 [0,0,0,0,0,1|1,1,0]=3 347 B11R1.91 O=C(O)CNC1=CC=NC=C1 Z2350906909 [0,0,0,0,0,1|2,1,0]=4 348 B11R1.91 O=C(O)CNC1=CN=CC=C1 Z3058782338 [0,0,0,0,0,1|2,1,0]=4 349 B11R1.91 O=C(O)CNC1=NC=CC=C1 Z2470036492 [0,0,0,0,0,1|2,1,0]=4 350 B11R1.91 O=C(O)COC1=CC=CC=C1 Z57182011 [0,0,0,0,0,1|2,1,0]=4 351 B11R1.91 O=C(O)CSC1=CC=CC=C1 Z104484982 [0,0,0,0,0,1|2,1,0]=4 352 B8R1.2 C=CC1=CC=CC=C1 Z104474664 [2,0,0,0,0,0|1,0,0]=3 353 B8R1.2 C=CC1=NC=CC=C1 Z104495554 [2,0,0,0,0,0|2,0,0]=4 354 B8R1.2 CCC1=CC=CC=C1 Z104473632 [2,0,0,0,0,0|1,0,1]=4 355 B8R1.2 CNC1=CC=CC=C1 Z104472478 [2,0,0,0,0,0|0,0,1]=3 356 B8R1.2 CNC1=CN=CC=C1 Z1082871080 [2,0,0,0,0,0|1,0,1]=4 357 B8R1.2 COC1=CC=CC=C1 Z53833865 [2,0,0,0,0,0|1,0,1]=4 358 B8R1.2 Cl[Se]C1=CC=CC=C1 Z1255485131 [2,0,0,0,0,0|2,0,0]=4 359 B8R1.2 N#CC1=CC=CC=C1 Z104473628 [2,0,0,0,0,0|0,0,2]=4 360 B8R1.2 NCC1=CC=CC=C1 Z54748260 [2,0,0,0,0,0|0,0,1]=3 361 B8R1.2 NCC1=CC=NC=C1 Z104474354 [2,0,0,0,0,0|1,0,1]=4 362 B8R1.2 NCC1=CN=CC=C1 Z104474366 [2,0,0,0,0,0|1,0,1]=4 363 B8R1.2 NCC1=NC=CC=C1 Z104474352 [2,0,0,0,0,0|1,0,1]=4 364 B8R1.2 NNC1=CC=CC=C1 Z104472442 [2,0,0,0,0,0|0,0,0]=2 365 B8R1.2 NNC1=NC=CC=C1 Z56887722 [2,0,0,0,0,0|1,0,0]=3 366 B8R1.2 O=CC1=CC=NC=C1 Z57161993 [2,0,0,0,0,0|1,1,0]=4 367 B8R1.2 O=CC1=CN=CC=C1 Z104472124 [2,0,0,0,0,0|1,1,0]=4 368 B8R1.2 O=CC1=NC=CC=C1 Z104472152 [2,0,0,0,0,0|1,1,0]=4 369 B8R1.2 OCC1=CC=CC=C1 Z104476418 [2,0,0,0,0,0|0,1,1]=4 370 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [1,1,0,0,0,0|1,1,0]=4 371 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [1,1,0,0,0,0|1,0,1]=4 372 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [1,1,0,0,0,0|1,0,1]=4 373 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [1,1,0,0,0,0|1,0,1]=4 374 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [1,1,0,0,0,0|1,0,1]=4 375 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [1,1,0,0,0,0|1,0,1]=4 376 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [1,1,0,0,0,0|1,0,1]=4 377 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [1,1,0,0,0,0|1,0,1]=4 378 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [1,1,0,0,0,0|1,0,1]=4 379 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [1,1,0,0,0,0|1,0,1]=4 380 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [1,1,0,0,0,0|1,0,1]=4 381 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [1,1,0,0,0,0|1,0,1]=4 382 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [1,1,0,0,0,0|2,0,0]=4 383 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [1,1,0,0,0,0|1,1,0]=4 384 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [1,1,0,0,0,0|1,1,0]=4 385 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [1,1,0,0,0,0|1,1,0]=4 386 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [1,1,0,0,0,0|0,1,0]=3 387 B10R1.4 C=CCC1=C(C=CC=C1)O Z104493210 [1,1,0,0,0,0|2,0,0]=4 388 B10R1.4 CC1=C(C=CC=C1)CC=O Z993017618 [1,1,0,0,0,0|1,1,0]=4 389 B10R1.4 CC1=C(C=CC=C1)CNN Z336481586 [1,1,0,0,0,0|2,0,0]=4 390 B10R1.4 CCNC1=C(C=CC=C1)C Z104477886 [1,1,0,0,0,0|1,0,1]=4 391 B10R1.4 CCNC1=C(C=CC=C1)F Z286518592 [1,1,0,0,0,0|1,0,1]=4 392 B10R1.4 CCNC1=C(C=CC=C1)I Z4405452872 [1,1,0,0,0,0|1,0,1]=4 393 B10R1.4 CCNC1=C(C=CC=C1)N Z359511482 [1,1,0,0,0,0|1,0,1]=4 394 B10R1.4 CCNC1=C(C=CC=C1)O Z5185414820 [1,1,0,0,0,0|1,0,1]=4 395 B10R1.4 N#CNC1=C(C=CC=C1)Cl Z991532350 [1,1,0,0,0,0|0,0,2]=4 396 B10R1.4 NCCC1=C(C=CC=C1)Br Z295382782 [1,1,0,0,0,0|1,0,1]=4 397 B10R1.4 NCCC1=C(C=CC=C1)Cl Z285143744 [1,1,0,0,0,0|1,0,1]=4 398 B10R1.4 NCCC1=C(C=CC=C1)F Z57051087 [1,1,0,0,0,0|1,0,1]=4 399 B10R1.4 NCCC1=C(C=CC=C1)O Z594038184 [1,1,0,0,0,0|1,0,1]=4 400 B10R1.4 O=CCC1=C(C=CC=C1)Br Z1183459130 [1,1,0,0,0,0|1,1,0]=4 401 B10R1.4 O=CCC1=C(C=CC=C1)F Z993017796 [1,1,0,0,0,0|1,1,0]=4 402 B10R1.10 C=COC1=CC=CC(=C1)C Z1269547004 [1,1,0,0,0,0|2,0,0]=4 403 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [1,1,0,0,0,0|1,0,1]=4 404 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [1,1,0,0,0,0|1,0,1]=4 405 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [1,1,0,0,0,0|1,0,1]=4 406 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [1,1,0,0,0,0|1,0,1]=4 407 B10R1.10 N#CNC1=CC=CC(=C1)Cl Z991532332 [1,1,0,0,0,0|0,0,2]=4 408 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [1,1,0,0,0,0|0,1,0]=3 409 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [1,1,0,0,0,0|1,0,1]=4 410 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [1,1,0,0,0,0|1,0,1]=4 411 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [1,1,0,0,0,0|1,0,1]=4 412 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [1,1,0,0,0,0|1,0,1]=4 413 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [1,1,0,0,0,0|1,0,1]=4 414 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [1,1,0,0,0,0|2,0,0]=4 415 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [1,1,0,0,0,0|1,1,0]=4 416 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [1,1,0,0,0,0|1,1,0]=4 417 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [1,1,0,0,0,0|0,1,0]=3 418 B10R1.10 S=C=NC1=CC=CC(=C1)Cl Z56926571 [1,1,0,0,0,0|0,0,2]=4 419 B10R1.15 C=C(CN)C1=CC=CC=C1 Z2065464323 [1,1,0,0,0,0|1,0,1]=4 420 B10R1.15 C=CC(O)C1=CC=CC=C1 Z1255438717 [1,1,0,0,0,0|2,0,0]=4 421 B10R1.15 CC(C=O)C1=CC=CC=C1 Z104495674 [1,1,0,0,0,0|1,1,0]=4 422 B10R1.15 CN(N=O)C1=CC=CC=C1 Z87001980 [1,1,0,0,0,0|1,1,0]=4 423 B10R1.15 C[C@H](CN)C1=CC=CC=C1 Z1203578128 [1,1,0,0,0,0|1,0,1]=4 424 B10R1.15 NCC(=O)C1=CC=CC=C1 Z600428568 [1,1,0,0,0,0|1,0,1]=4 425 B10R1.15 NCC(N)C1=CC=CC=C1 Z425861034 [1,1,0,0,0,0|1,0,1]=4 426 B10R1.15 NCC(O)C1=CC=CC=C1 Z104476088 [1,1,0,0,0,0|1,0,1]=4 427 B10R1.15 NNC(=O)C1=CC=CC=C1 Z56926669 [1,1,0,0,0,0|2,0,0]=4 428 B10R1.15 O=CC(=O)C1=CC=CC=C1 Z1954804411 [1,1,0,0,0,0|1,1,0]=4 429 B10R1.17 CCNCC1=CC=CC=C1 Z57327176 [1,1,0,0,0,0|1,0,1]=4 430 B10R1.17 CNCCC1=CC=CC=C1 Z445226260 [1,1,0,0,0,0|1,0,1]=4 431 B10R1.17 N#CCNC1=CC=CC=C1 Z56347332 [1,1,0,0,0,0|0,0,2]=4 432 B10R1.17 NC/C=C/C1=CC=CC=C1 Z2953771905 [1,1,0,0,0,0|1,0,0]=3 433 B10R1.17 NC/C=C/C1=CN=CC=C1 Z2216303151 [1,1,0,0,0,0|2,0,0]=4 434 B10R1.17 NCC#CC1=CC=CC=C1 Z227964210 [1,1,0,0,0,0|1,0,1]=4 435 B10R1.17 NCCCC1=CC=CC=C1 Z104478312 [1,1,0,0,0,0|1,0,1]=4 436 B10R1.17 NCCNC1=CC=NC=C1 Z317257862 [1,1,0,0,0,0|1,0,1]=4 437 B10R1.17 NCCNC1=NC=CC=C1 Z85923460 [1,1,0,0,0,0|1,0,1]=4 438 B10R1.17 NCCOC1=CC=CC=C1 Z355423232 [1,1,0,0,0,0|1,0,1]=4 439 B10R1.17 NCCSC1=CC=CC=C1 Z57970213 [1,1,0,0,0,0|1,0,1]=4 440 B10R1.17 NNCCC1=CC=CC=C1 Z927192062 [1,1,0,0,0,0|1,0,1]=4 441 B10R1.17 O=C/C=C/C1=CC=CC=C1 Z3219847383 [1,1,0,0,0,0|1,1,0]=4 442 B10R1.17 O=CC#CC1=CC=CC=C1 Z1255485337 [1,1,0,0,0,0|1,1,0]=4 443 B10R1.17 O=CCCC1=CC=CC=C1 Z87002472 [1,1,0,0,0,0|1,1,0]=4 444 B10R1.17 O=CCOC1=CC=CC=C1 Z854102570 [1,1,0,0,0,0|1,1,0]=4 445 B10R1.17 O=CNCC1=CC=CC=C1 Z1203730748 [1,1,0,0,0,0|0,1,0]=3 446 B10R1.17 O=CNNC1=CC=CC=C1 Z1198148433 [1,1,0,0,0,0|0,1,0]=3 447 B10R1.17 OC/C=C/C1=CC=CC=C1 Z104473562 [1,1,0,0,0,0|1,1,0]=4 448 B10R1.17 S=C=NCC1=CC=CC=C1 Z56869309 [1,1,0,0,0,0|0,0,2]=4 449 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [0,1,0,0,1,0|1,1,0]=4 450 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [0,1,0,0,1,0|1,1,0]=4 451 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [0,1,0,0,1,0|1,1,0]=4 452 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [0,1,0,0,1,0|1,1,0]=4 453 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [0,1,0,0,1,0|1,1,0]=4 454 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [0,1,0,0,1,0|1,1,0]=4 455 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [0,1,0,0,1,0|1,1,0]=4 456 B10R1.13 CC(N)C1=CC=C(C=C1)Br Z56347162 [0,1,0,0,1,0|1,0,1]=4 457 B10R1.13 CC(N)C1=CC=C(C=C1)Cl Z56347112 [0,1,0,0,1,0|1,0,1]=4 458 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [0,1,0,0,1,0|1,0,1]=4 459 B10R1.13 CC1=CC=C(C=C1)C(=N)N Z1405445841 [0,1,0,0,1,0|1,0,0]=3 460 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [0,1,0,0,1,0|1,1,0]=4 461 B10R1.13 CC1=CC=C(C=C1)C(=S)N Z56939152 [0,1,0,0,1,0|0,0,0]=2 462 B10R1.13 CC1=NC=C(C=C1)C(=O)N Z57493539 [0,1,0,0,1,0|1,1,0]=4 463 B10R1.13 C[C@H](N)C1=CC=C(C=C1)Br Z1869802525 [0,1,0,0,1,0|1,0,1]=4 464 B10R1.13 C[C@H](N)C1=CC=C(C=C1)I Z1696091699 [0,1,0,0,1,0|1,0,1]=4 465 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [0,1,0,0,1,0|1,0,1]=4 466 B10R1.13 N=C(N)C1=CC=C(C=C1)Br Z1263602346 [0,1,0,0,1,0|1,0,0]=3 467 B10R1.13 N=C(N)C1=CC=C(C=C1)Cl Z56771179 [0,1,0,0,1,0|1,0,0]=3 468 B10R1.13 N=C(N)C1=CC=C(C=C1)F Z2289798423 [0,1,0,0,1,0|1,0,0]=3 469 B10R1.13 N=C(N)C1=CC=C(C=C1)I Z2574914411 [0,1,0,0,1,0|1,0,0]=3 470 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [0,1,0,0,1,0|1,0,0]=3 471 B10R1.13 N=C(N)C1=CN=C(C=C1)Cl Z1696091820 [0,1,0,0,1,0|2,0,0]=4 472 B10R1.13 N=C(N)C1=NC=C(C=C1)Br Z3234809794 [0,1,0,0,1,0|2,0,0]=4 473 B10R1.13 N=C(N)C1=NC=C(C=C1)Cl Z3234813314 [0,1,0,0,1,0|2,0,0]=4 474 B10R1.13 N=C(N)C1=NC=C(C=C1)F Z1255388124 [0,1,0,0,1,0|2,0,0]=4 475 B10R1.13 N=C(N)C1=NC=C(C=C1)N Z2740001122 [0,1,0,0,1,0|2,0,0]=4 476 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [0,1,0,0,1,0|0,1,0]=3 477 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [0,1,0,0,1,0|0,1,0]=3 478 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [0,1,0,0,1,0|0,1,0]=3 479 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [0,1,0,0,1,0|0,1,0]=3 480 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [0,1,0,0,1,0|0,1,0]=3 481 B10R1.13 NC(=O)C1=CN=C(C=C1)Cl Z33546654 [0,1,0,0,1,0|1,1,0]=4 482 B10R1.13 NC(=O)C1=CN=C(C=C1)F Z1183725924 [0,1,0,0,1,0|1,1,0]=4 483 B10R1.13 NC(=O)C1=CN=C(C=C1)N Z959893184 [0,1,0,0,1,0|1,1,0]=4 484 B10R1.13 NC(=O)C1=CNC(=O)C=C1 Z220564282 [0,1,0,0,1,0|1,1,0]=4 485 B10R1.13 NC(=O)C1=NC=C(C=C1)Br Z1065600734 [0,1,0,0,1,0|1,1,0]=4 486 B10R1.13 NC(=O)C1=NC=C(C=C1)I Z1269145218 [0,1,0,0,1,0|1,1,0]=4 487 B10R1.13 NC(=O)C1=NC=C(C=C1)N Z1116403989 [0,1,0,0,1,0|1,1,0]=4 488 B10R1.13 NC(=S)C1=CC=C(C=C1)Br Z56964597 [0,1,0,0,1,0|0,0,0]=2 489 B10R1.13 NC(=S)C1=CC=C(C=C1)Cl Z57070431 [0,1,0,0,1,0|0,0,0]=2 490 B10R1.13 NC(=S)C1=CC=C(C=C1)N Z234895465 [0,1,0,0,1,0|0,0,0]=2 491 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [0,1,0,0,1,0|0,0,0]=2 492 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [0,1,0,0,1,0|1,1,0]=4 493 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [0,1,0,0,1,0|1,1,0]=4 494 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [0,1,0,0,1,0|1,1,0]=4 495 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [0,1,0,0,1,0|1,1,0]=4 496 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [0,1,0,0,1,0|1,1,0]=4 497 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [0,1,0,0,1,0|1,1,0]=4 498 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [0,1,0,0,1,0|1,1,0]=4 499 B10R1.28 CC(C)(N)C1=CC=CC=C1 Z336079658 [0,1,0,0,1,0|1,0,1]=4 500 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 Z45415554 [0,1,0,0,1,0|1,1,0]=4 501 B10R1.61 C=C(C)C1=C(C=CC=C1)Br Z1238836250 [0,1,0,0,1,0|2,0,0]=4 502 B10R1.61 CC(=O)C1=C(C=CC=C1)Br Z219997444 [0,1,0,0,1,0|1,1,0]=4 503 B10R1.61 CC(=O)C1=C(C=CC=C1)Cl Z104473116 [0,1,0,0,1,0|1,1,0]=4 504 B10R1.61 CC(=O)C1=C(C=CC=C1)F Z104475574 [0,1,0,0,1,0|1,1,0]=4 505 B10R1.61 CC(=O)C1=C(C=CC=C1)I Z1080378952 [0,1,0,0,1,0|1,1,0]=4 506 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [0,1,0,0,1,0|1,1,0]=4 507 B10R1.61 CC(N)C1=C(C=CC=C1)F Z56347426 [0,1,0,0,1,0|1,0,1]=4 508 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [0,1,0,0,1,0|1,0,1]=4 509 B10R1.61 CC1=C(C=CC=C1)C(=N)N Z1483957011 [0,1,0,0,1,0|1,0,0]=3 510 B10R1.61 CC1=C(C=CC=C1)C(=O)O Z104495626 [0,1,0,0,1,0|1,1,0]=4 511 B10R1.61 CC1=C(C=CC=C1)C(=S)N Z57046956 [0,1,0,0,1,0|0,0,0]=2 512 B10R1.61 CC1=C(C=CN=C1)C(=O)N Z1198162078 [0,1,0,0,1,0|1,1,0]=4 513 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Br Z1696289917 [0,1,0,0,1,0|1,0,1]=4 514 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Cl Z360055184 [0,1,0,0,1,0|1,0,1]=4 515 B10R1.61 C[C@H](N)C1=C(C=CC=C1)Br Z1696289881 [0,1,0,0,1,0|1,0,1]=4 516 B10R1.61 N=C(N)C1=C(C=CC=C1)Br Z1266823189 [0,1,0,0,1,0|1,0,0]=3 517 B10R1.61 N=C(N)C1=C(C=CC=C1)Cl Z1695669929 [0,1,0,0,1,0|1,0,0]=3 518 B10R1.61 N=C(N)C1=C(C=CC=C1)F Z2442104317 [0,1,0,0,1,0|1,0,0]=3 519 B10R1.61 N=C(N)C1=C(C=CC=C1)N Z199055442 [0,1,0,0,1,0|1,0,0]=3 520 B10R1.61 N=C(N)C1=C(C=CC=C1)O Z1431002716 [0,1,0,0,1,0|1,0,0]=3 521 B10R1.61 NC(=O)C1=C(C=CC=C1)Cl Z33546379 [0,1,0,0,1,0|0,1,0]=3 522 B10R1.61 NC(=O)C1=C(C=CC=C1)F Z33546498 [0,1,0,0,1,0|0,1,0]=3 523 B10R1.61 NC(=O)C1=C(C=CC=C1)I Z33546623 [0,1,0,0,1,0|0,1,0]=3 524 B10R1.61 NC(=O)C1=C(C=CC=C1)N Z57036632 [0,1,0,0,1,0|0,1,0]=3 525 B10R1.61 NC(=O)C1=C(C=CC=C1)O Z68590124 [0,1,0,0,1,0|0,1,0]=3 526 B10R1.61 NC(=O)C1=C(C=CC=N1)N Z1083218598 [0,1,0,0,1,0|1,1,0]=4 527 B10R1.61 NC(=O)C1=C(C=CN=C1)Cl Z1198275382 [0,1,0,0,1,0|1,1,0]=4 528 B10R1.61 NC(=O)C1=C(C=CN=C1)O Z1198177193 [0,1,0,0,1,0|1,1,0]=4 529 B10R1.61 NC(=O)C1=C(C=NC=C1)Br Z1269114039 [0,1,0,0,1,0|1,1,0]=4 530 B10R1.61 NC(=O)C1=C(C=NC=C1)Cl Z1198237797 [0,1,0,0,1,0|1,1,0]=4 531 B10R1.61 NC(=O)C1=C(N=CC=C1)Cl Z33546502 [0,1,0,0,1,0|1,1,0]=4 532 B10R1.61 NC(=S)C1=C(C=CC=C1)N Z99601360 [0,1,0,0,1,0|0,0,0]=2 533 B10R1.61 O=C(O)C1=C(C=CC=C1)Br Z57825381 [0,1,0,0,1,0|1,1,0]=4 534 B10R1.61 O=C(O)C1=C(C=CC=C1)Cl Z57127537 [0,1,0,0,1,0|1,1,0]=4 535 B10R1.61 O=C(O)C1=C(C=CC=C1)F Z57914061 [0,1,0,0,1,0|1,1,0]=4 536 B10R1.61 O=C(O)C1=C(C=CC=C1)I Z57637028 [0,1,0,0,1,0|1,1,0]=4 537 B10R1.61 O=C(O)C1=C(C=CC=C1)O Z56757226 [0,1,0,0,1,0|1,1,0]=4 538 B10R1.61 O=C(O)C1=C(C=CC=C1)S Z104477754 [0,1,0,0,1,0|1,1,0]=4 539 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [0,1,0,0,1,0|2,0,0]=4 540 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [0,1,0,0,1,0|1,1,0]=4 541 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [0,1,0,0,1,0|1,1,0]=4 542 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [0,1,0,0,1,0|1,1,0]=4 543 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [0,1,0,0,1,0|1,1,0]=4 544 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [0,1,0,0,1,0|1,0,1]=4 545 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [0,1,0,0,1,0|1,0,1]=4 546 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [0,1,0,0,1,0|1,0,1]=4 547 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [0,1,0,0,1,0|1,0,1]=4 548 B10R1.113 CC1=CC(=CC=C1)C(=N)N Z2471262589 [0,1,0,0,1,0|1,0,0]=3 549 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [0,1,0,0,1,0|0,1,0]=3 550 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [0,1,0,0,1,0|1,1,0]=4 551 B10R1.113 CC1=CC(=CC=C1)C(=S)N Z90122768 [0,1,0,0,1,0|0,0,0]=2 552 B10R1.113 CC1=CC(=CN=C1)C(=O)N Z1203579033 [0,1,0,0,1,0|1,1,0]=4 553 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [0,1,0,0,1,0|1,0,1]=4 554 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [0,1,0,0,1,0|1,0,1]=4 555 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [0,1,0,0,1,0|1,0,1]=4 556 B10R1.113 CC1=NC(=CC=C1)C(=O)N Z287485516 [0,1,0,0,1,0|1,1,0]=4 557 B10R1.113 CC1=NC=CC(=C1)C(=O)N Z1203579723 [0,1,0,0,1,0|1,1,0]=4 558 B10R1.113 N=C(N)C1=CC(=CC=C1)Br Z1741973354 [0,1,0,0,1,0|1,0,0]=3 559 B10R1.113 N=C(N)C1=CC(=CC=C1)Cl Z1362754541 [0,1,0,0,1,0|1,0,0]=3 560 B10R1.113 N=C(N)C1=CC(=CC=C1)F Z1263714076 [0,1,0,0,1,0|1,0,0]=3 561 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [0,1,0,0,1,0|1,0,0]=3 562 B10R1.113 N=C(N)C1=CC(=CN=C1)Br Z1741981976 [0,1,0,0,1,0|2,0,0]=4 563 B10R1.113 N=C(N)C1=CC(=CN=C1)F Z2602277783 [0,1,0,0,1,0|2,0,0]=4 564 B10R1.113 N=C(N)C1=CC(=NC=C1)Cl Z1696861498 [0,1,0,0,1,0|2,0,0]=4 565 B10R1.113 N=C(N)C1=CC(=NC=C1)F Z3252328721 [0,1,0,0,1,0|2,0,0]=4 566 B10R1.113 N=C(N)C1=NC(=CC=C1)Br Z3688945008 [0,1,0,0,1,0|2,0,0]=4 567 B10R1.113 N=C(N)C1=NC(=CC=C1)Cl Z1255432409 [0,1,0,0,1,0|2,0,0]=4 568 B10R1.113 N=C(N)C1=NC(=CC=C1)N Z1592025387 [0,1,0,0,1,0|2,0,0]=4 569 B10R1.113 N=C(N)C1=NC=CC(=C1)Br Z1269169965 [0,1,0,0,1,0|2,0,0]=4 570 B10R1.113 N=C(N)C1=NC=CC(=C1)Cl Z3234812767 [0,1,0,0,1,0|2,0,0]=4 571 B10R1.113 N=C(N)C1=NC=CC(=C1)N Z1642389653 [0,1,0,0,1,0|2,0,0]=4 572 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [0,1,0,0,1,0|0,1,0]=3 573 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [0,1,0,0,1,0|0,1,0]=3 574 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [0,1,0,0,1,0|0,1,0]=3 575 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [0,1,0,0,1,0|0,1,0]=3 576 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [0,1,0,0,1,0|0,1,0]=3 577 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [0,1,0,0,1,0|0,1,0]=3 578 B10R1.113 NC(=O)C1=CC(=CN=C1)Br Z33546660 [0,1,0,0,1,0|1,1,0]=4 579 B10R1.113 NC(=O)C1=CC(=CN=C1)N Z1198184520 [0,1,0,0,1,0|1,1,0]=4 580 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [0,1,0,0,1,0|1,1,0]=4 581 B10R1.113 NC(=O)C1=CC(=NC=C1)Br Z1269224952 [0,1,0,0,1,0|1,1,0]=4 582 B10R1.113 NC(=O)C1=CC(=NC=C1)Cl Z147129672 [0,1,0,0,1,0|1,1,0]=4 583 B10R1.113 NC(=O)C1=CC(=NC=C1)F Z802658956 [0,1,0,0,1,0|1,1,0]=4 584 B10R1.113 NC(=O)C1=CC(=NC=C1)N Z733874990 [0,1,0,0,1,0|1,1,0]=4 585 B10R1.113 NC(=O)C1=NC(=CC=C1)Br Z1116315117 [0,1,0,0,1,0|1,1,0]=4 586 B10R1.113 NC(=O)C1=NC(=CC=C1)Cl Z969100498 [0,1,0,0,1,0|1,1,0]=4 587 B10R1.113 NC(=O)C1=NC(=CC=C1)N Z969101552 [0,1,0,0,1,0|1,1,0]=4 588 B10R1.113 NC(=O)C1=NC=CC(=C1)N Z425851730 [0,1,0,0,1,0|1,1,0]=4 589 B10R1.113 NC(=S)C1=CC(=CC=C1)Br Z56985752 [0,1,0,0,1,0|0,0,0]=2 590 B10R1.113 NC(=S)C1=CC(=CC=C1)Cl Z56979368 [0,1,0,0,1,0|0,0,0]=2 591 B10R1.113 NC(=S)C1=CC(=CC=C1)F Z56979300 [0,1,0,0,1,0|0,0,0]=2 592 B10R1.113 NC(=S)C1=CC(=NC=C1)Cl Z368561286 [0,1,0,0,1,0|1,0,0]=3 593 B10R1.113 NC(=S)C1=CC(=NC=C1)F Z3272631388 [0,1,0,0,1,0|1,0,0]=3 594 B10R1.113 NC(=S)C1=NC(=CC=C1)N Z1238673112 [0,1,0,0,1,0|1,0,0]=3 595 B10R1.113 NC(=S)C1=NC=CC(=C1)N Z1041133428 [0,1,0,0,1,0|1,0,0]=3 596 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [0,1,0,0,1,0|1,1,0]=4 597 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [0,1,0,0,1,0|1,1,0]=4 598 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [0,1,0,0,1,0|1,1,0]=4 599 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [0,1,0,0,1,0|1,1,0]=4 600 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [0,1,0,0,1,0|1,1,0]=4 601 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [0,1,0,0,1,0|1,1,0]=4 602 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [0,1,0,0,1,0|1,1,0]=4 603 B10R1.54 CN1C=C(C=N1)NC(=S)N Z431528978 [0,1,0,0,1,0|2,0,0]=4 604 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br Z816034502 [0,1,0,0,0,1|1,1,0]=4 605 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N Z600391558 [0,1,0,0,0,1|1,1,0]=4 606 B12R1.21 CC(=O)NNC1=CC=C(C=C1)F Z30877183 [0,1,0,0,0,1|1,1,0]=4 607 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [0,1,0,0,0,1|1,1,0]=4 608 B12R1.21 CC1=CC=C(C=C1)CNC(=N)N Z911465430 [0,1,0,0,0,1|1,0,0]=3 609 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N Z198194838 [0,1,0,0,0,1|0,1,0]=3 610 B12R1.21 CC1=CC=C(C=C1)CNC(=S)N Z56915894 [0,1,0,0,0,1|0,0,0]=2 611 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [0,1,0,0,0,1|1,1,0]=4 612 B12R1.21 CC1=CC=C(C=C1)OCC(=S)N Z295396970 [0,1,0,0,0,1|1,0,0]=3 613 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [0,1,0,0,0,1|1,1,0]=4 614 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Br Z48820389 [0,1,0,0,0,1|2,0,0]=4 615 B12R1.21 N=C(N)SCC1=CC=C(C=C1)Cl Z48820386 [0,1,0,0,0,1|2,0,0]=4 616 B12R1.21 NC(=O)/C=C/C1=CC=C(C=C1)Br Z33545605 [0,1,0,0,0,1|1,1,0]=4 617 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [0,1,0,0,0,1|1,1,0]=4 618 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [0,1,0,0,0,1|1,1,0]=4 619 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Br Z104586672 [0,1,0,0,0,1|0,1,0]=3 620 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [0,1,0,0,0,1|0,1,0]=3 621 B12R1.21 NC(=O)CNC1=CC=C(C=C1)I Z104728120 [0,1,0,0,0,1|0,1,0]=3 622 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [0,1,0,0,0,1|1,1,0]=4 623 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [0,1,0,0,0,1|1,1,0]=4 624 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [0,1,0,0,0,1|1,1,0]=4 625 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [0,1,0,0,0,1|1,1,0]=4 626 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [0,1,0,0,0,1|1,1,0]=4 627 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [0,1,0,0,0,1|1,1,0]=4 628 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [0,1,0,0,0,1|1,1,0]=4 629 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F Z198194834 [0,1,0,0,0,1|0,1,0]=3 630 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N Z600391988 [0,1,0,0,0,1|0,1,0]=3 631 B12R1.21 NC(=S)COC1=CC=C(C=C1)Cl Z295395122 [0,1,0,0,0,1|1,0,0]=3 632 B12R1.21 NC(=S)NCC1=CC=C(C=C1)F Z111411726 [0,1,0,0,0,1|0,0,0]=2 633 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br Z274534708 [0,1,0,0,0,1|1,1,0]=4 634 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl Z274534702 [0,1,0,0,0,1|1,1,0]=4 635 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [0,1,0,0,0,1|1,1,0]=4 636 B12R1.27 C#CC(=O)NCC1=CC=CC=C1 Z1509142729 [0,1,0,0,0,1|1,1,0]=4 637 B12R1.27 C/N=C(\N)/NCC1=CN=CC=C1 Z1090000620 [0,1,0,0,0,1|2,0,0]=4 638 B12R1.27 C=CC(=O)NCC1=CC=CC=C1 Z56757233 [0,1,0,0,0,1|1,1,0]=4 639 B12R1.27 CCC(N)CNC1=CC=CC=C1 Z756919558 [0,1,0,0,0,1|1,0,1]=4 640 B12R1.27 CNC(=O)CCC1=CC=CC=C1 Z32016418 [0,1,0,0,0,1|1,1,0]=4 641 B12R1.27 CNC(=O)COC1=CC=CC=C1 Z19735428 [0,1,0,0,0,1|1,1,0]=4 642 B12R1.27 CNC(=O)CSC1=CC=CC=C1 Z19750829 [0,1,0,0,0,1|1,1,0]=4 643 B12R1.27 CNC(=O)OCC1=CC=CC=C1 Z32016983 [0,1,0,0,0,1|1,1,0]=4 644 B12R1.27 COC(=O)CNC1=CC=CC=C1 Z1250132387 [0,1,0,0,0,1|1,1,0]=4 645 B12R1.27 COC(=O)NNC1=CC=CC=C1 Z56755853 [0,1,0,0,0,1|1,1,0]=4 646 B12R1.27 N/C(=N\O)/CCC1=CC=CC=C1 Z285132818 [0,1,0,0,0,1|1,1,0]=4 647 B12R1.27 N/C(=N\O)/COC1=CC=CC=C1 Z104341168 [0,1,0,0,0,1|1,1,0]=4 648 B12R1.27 NCC(=O)CCC1=CC=CC=C1 Z3719299469 [0,1,0,0,0,1|1,1,0]=4 649 B12R1.27 NCC(=O)NCC1=CC=CC=C1 Z398557160 [0,1,0,0,0,1|0,1,0]=3 650 B12R1.27 NCC(=O)NCC1=CC=NC=C1 Z1262246178 [0,1,0,0,0,1|1,1,0]=4 651 B12R1.27 NCC(=O)OCC1=CC=CC=C1 Z56904671 [0,1,0,0,0,1|1,1,0]=4 652 B12R1.27 NNC(=O)CNC1=CC=CC=C1 Z56886393 [0,1,0,0,0,1|0,1,0]=3 653 B12R1.27 NNC(=S)NCC1=CC=CC=C1 Z56828396 [0,1,0,0,0,1|0,0,0]=2 654 B12R1.27 NNC(=S)NCC1=CN=CC=C1 Z56887673 [0,1,0,0,0,1|1,0,0]=3 655 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 Z56896328 [0,1,0,0,0,1|1,1,0]=4 656 B12R1.27 O=C(CO)NCC1=CC=CC=C1 Z228585446 [0,1,0,0,0,1|1,1,0]=4 657 B12R1.43 CC(N)C(=O)NC1=CC=CC=C1 Z1266933914 [0,1,0,0,0,1|1,0,1]=4 658 B12R1.43 CC(NC1=CC=CC=C1)C(=O)O Z57982184 [0,1,0,0,0,1|1,1,0]=4 659 B12R1.43 CC(SC1=CC=CC=C1)C(=O)N Z19751098 [0,1,0,0,0,1|1,1,0]=4 660 B12R1.43 CN(CC1=CC=CC=C1)C(=O)N Z198194348 [0,1,0,0,0,1|0,1,0]=3 661 B12R1.43 CN(CC1=CC=CC=C1)C(=S)N Z228582754 [0,1,0,0,0,1|0,0,0]=2 662 B12R1.43 CN(CC1=CC=NC=C1)C(=N)N Z2235790707 [0,1,0,0,0,1|2,0,0]=4 663 B12R1.43 CN(CC1=NC=CC=C1)C(=O)N Z431977624 [0,1,0,0,0,1|1,1,0]=4 664 B12R1.43 CN(N)C(=O)NC1=CC=CC=C1 Z56855649 [0,1,0,0,0,1|2,0,0]=4 665 B12R1.43 CN(N)C(=S)NC1=CC=CC=C1 Z56844976 [0,1,0,0,0,1|2,0,0]=4 666 B12R1.43 NC(=O)C(N)CC1=CC=CC=C1 Z317075516 [0,1,0,0,0,1|1,1,0]=4 667 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 Z760046820 [0,1,0,0,0,1|1,1,0]=4 668 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 Z933616656 [0,1,0,0,0,1|1,1,0]=4 669 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 Z362848468 [0,1,0,0,0,1|1,1,0]=4 670 B12R1.107 CC(CC(=O)N)C1=CC=CC=C1 Z33546734 [0,1,0,0,0,1|1,1,0]=4 671 B12R1.107 CC(N)CN(C)C1=CC=CC=C1 Z815264124 [0,1,0,0,0,1|1,0,1]=4 672 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 Z1089996260 [0,1,0,0,0,1|1,0,0]=3 673 B12R1.107 CC(NC(=O)N)C1=CC=CC=C1 Z198194342 [0,1,0,0,0,1|0,1,0]=3 674 B12R1.107 CC(NC(=S)N)C1=CC=CC=C1 Z56913099 [0,1,0,0,0,1|0,0,0]=2 675 B12R1.107 CN(CC(=O)N)C1=CC=CC=C1 Z54747686 [0,1,0,0,0,1|0,1,0]=3 676 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 Z1162448842 [0,1,0,0,0,1|1,1,0]=4 677 B12R1.107 N=C(N)NC(=O)C1=CC=CC=C1 Z1198149259 [0,1,0,0,0,1|1,0,0]=3 678 B12R1.107 O=C(O)NC(=O)C1=CC=CC=C1 Z56928966 [0,1,0,0,0,1|1,1,0]=4 679 B12R1.125 C=C(C)CNC1=C(C=CC=C1)Br Z297649770 [0,1,0,0,0,1|2,0,0]=4 680 B12R1.125 CC(=O)NCC1=C(C=CC=C1)F Z29857733 [0,1,0,0,0,1|1,1,0]=4 681 B12R1.125 CC(=O)NCC1=C(C=CC=C1)N Z3711224127 [0,1,0,0,0,1|1,1,0]=4 682 B12R1.125 CC1=C(C=CC=C1)NCC(=O)N Z104590676 [0,1,0,0,0,1|0,1,0]=3 683 B12R1.125 CC1=C(C=CC=C1)OCC(=N)N Z823287452 [0,1,0,0,0,1|2,0,0]=4 684 B12R1.125 CC1=C(C=CC=C1)OCC(=O)N Z19733874 [0,1,0,0,0,1|1,1,0]=4 685 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [0,1,0,0,0,1|1,0,0]=3 686 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [0,1,0,0,0,1|2,0,0]=4 687 B12R1.125 NC(=O)CCC1=C(C=CC=C1)Br Z741559968 [0,1,0,0,0,1|1,1,0]=4 688 B12R1.125 NC(=O)CCC1=C(C=CC=C1)N Z414316848 [0,1,0,0,0,1|1,1,0]=4 689 B12R1.125 NC(=O)CCC1=C(C=CC=C1)O Z371352778 [0,1,0,0,0,1|1,1,0]=4 690 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Br Z137588472 [0,1,0,0,0,1|0,1,0]=3 691 B12R1.125 NC(=O)CNC1=C(C=CC=C1)Cl Z104528166 [0,1,0,0,0,1|0,1,0]=3 692 B12R1.125 NC(=O)CNC1=C(C=CC=C1)I Z133437412 [0,1,0,0,0,1|0,1,0]=3 693 B12R1.125 NC(=O)COC1=C(C=CC=C1)Br Z17829253 [0,1,0,0,0,1|1,1,0]=4 694 B12R1.125 NC(=O)COC1=C(C=CC=C1)Cl Z19726626 [0,1,0,0,0,1|1,1,0]=4 695 B12R1.125 NC(=O)COC1=C(C=CC=C1)F Z19724798 [0,1,0,0,0,1|1,1,0]=4 696 B12R1.125 NC(=O)COC1=C(C=CC=C1)I Z406416164 [0,1,0,0,0,1|1,1,0]=4 697 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Br Z149386624 [0,1,0,0,0,1|1,1,0]=4 698 B12R1.125 NC(=O)CSC1=C(C=CC=C1)Cl Z18459622 [0,1,0,0,0,1|1,1,0]=4 699 B12R1.125 NC(=O)CSC1=C(C=CC=C1)N Z57332466 [0,1,0,0,0,1|1,1,0]=4 700 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [0,1,0,0,0,1|0,1,0]=3 701 B12R1.125 NC(=O)NCC1=C(C=CC=C1)F Z198194842 [0,1,0,0,0,1|0,1,0]=3 702 B12R1.125 O=C(O)CNC1=C(C=CC=C1)Cl Z274534698 [0,1,0,0,0,1|1,1,0]=4 703 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br Z340632658 [0,1,0,0,0,1|1,1,0]=4 704 B12R1.226 CC(=O)NCC1=CC(=CC=C1)F Z340527618 [0,1,0,0,0,1|1,1,0]=4 705 B12R1.226 CC(=O)NNC1=CC(=CC=C1)C Z30552180 [0,1,0,0,0,1|1,1,0]=4 706 B12R1.226 CC1=CC(=CC=C1)CCC(=O)N Z194976514 [0,1,0,0,0,1|1,1,0]=4 707 B12R1.226 CC1=CC(=CC=C1)CNC(=S)N Z847147370 [0,1,0,0,0,1|0,0,0]=2 708 B12R1.226 CC1=CC(=CC=C1)CSC(=N)N Z57992123 [0,1,0,0,0,1|2,0,0]=4 709 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [0,1,0,0,0,1|0,1,0]=3 710 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N Z19732960 [0,1,0,0,0,1|1,1,0]=4 711 B12R1.226 N=C(N)SCC1=CC(=CC=C1)F Z48820172 [0,1,0,0,0,1|2,0,0]=4 712 B12R1.226 NC(=O)CCC1=CC(=CC=C1)N Z414316850 [0,1,0,0,0,1|1,1,0]=4 713 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [0,1,0,0,0,1|0,1,0]=3 714 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [0,1,0,0,0,1|0,1,0]=3 715 B12R1.226 NC(=O)COC1=CC(=CC=C1)F Z19755608 [0,1,0,0,0,1|1,1,0]=4 716 B12R1.226 NC(=O)COC1=CC(=CC=C1)I Z25076202 [0,1,0,0,0,1|1,1,0]=4 717 B12R1.226 NC(=O)COC1=CC(=CC=C1)N Z235344273 [0,1,0,0,0,1|1,1,0]=4 718 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [0,1,0,0,0,1|1,1,0]=4 719 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [0,1,0,0,0,1|0,1,0]=3 720 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl Z274534700 [0,1,0,0,0,1|1,1,0]=4 721 B12R1.891 CC(C)(N)CNC1=CC=CC=C1 Z801831906 [0,1,0,0,0,1|1,0,1]=4 722 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 Z300098430 [0,1,0,0,0,1|1,1,0]=4 723 B12R1.4 C#CC1=CC=C(C=C1)NC(=O)C Z1509142033 [0,2,0,0,0,0|1,1,0]=4 724 B12R1.4 CC(=O)NC1=CC=C(C=C1)C#N Z30612220 [0,2,0,0,0,0|1,1,0]=4 725 B12R1.4 CC(=O)NC1=CC=C(C=C1)C=O Z104472864 [0,2,0,0,0,0|1,1,0]=4 726 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN Z235336571 [0,2,0,0,0,0|1,1,0]=4 727 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [0,2,0,0,0,0|1,1,0]=4 728 B12R1.4 CCC1=CC=C(C=C1)NC(=O)C Z30917832 [0,2,0,0,0,0|1,1,0]=4 729 B12R1.4 CCC1=CC=C(C=C1)NC(=S)N Z271134316 [0,2,0,0,0,0|0,0,0]=2 730 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C Z335252368 [0,2,0,0,0,0|1,1,0]=4 731 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [0,2,0,0,0,0|1,1,0]=4 732 B12R1.4 COC1=CC=C(C=C1)NC(=N)N Z118438372 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [0,2,0,0,0,0|1,1,0]=4 734 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [0,2,0,0,0,0|0,1,0]=3 735 B12R1.4 COC1=CC=C(C=C1)NC(=S)N Z56921428 [0,2,0,0,0,0|0,0,0]=2 736 B12R1.4 CSC1=CC=C(C=C1)NC(=O)C Z25066204 [0,2,0,0,0,0|1,1,0]=4 737 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N Z982774006 [0,2,0,0,0,0|1,1,0]=4 738 B12R1.4 N#CC1=CC=C(C=C1)NC(=O)N Z220331754 [0,2,0,0,0,0|0,1,0]=3 739 B12R1.4 N#CC1=CC=C(C=C1)NC(=S)N Z291279010 [0,2,0,0,0,0|0,0,0]=2 740 B12R1.4 NCC1=CC=C(C=C1)NC(=O)N Z228589054 [0,2,0,0,0,0|0,1,0]=3 741 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Br)C Z30826447 [0,2,0,0,0,0|1,1,0]=4 742 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Br Z296850122 [0,2,0,0,0,0|1,1,0]=4 743 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Cl Z28153679 [0,2,0,0,0,0|1,1,0]=4 744 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)F Z30955086 [0,2,0,0,0,0|1,1,0]=4 745 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)N Z274783012 [0,2,0,0,0,0|1,1,0]=4 746 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)Cl Z28128347 [0,2,0,0,0,0|1,1,0]=4 747 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)N Z239122040 [0,2,0,0,0,0|1,1,0]=4 748 B12R1.19 CC(=O)NC1=CC(=C(C=C1)F)N Z235362917 [0,2,0,0,0,0|1,1,0]=4 749 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Cl Z425366400 [0,2,0,0,0,0|1,1,0]=4 750 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,2,0,0,0,0|1,1,0]=4 751 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)C Z107732966 [0,2,0,0,0,0|0,1,0]=3 752 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)F Z198194884 [0,2,0,0,0,0|0,1,0]=3 753 B12R1.19 CC1=C(C=C(C=C1)NC(=S)N)C Z56951808 [0,2,0,0,0,0|0,0,0]=2 754 B12R1.19 CC1=C(C=C(C=C1)NC(=S)N)F Z111411720 [0,2,0,0,0,0|0,0,0]=2 755 B12R1.19 CC1=C(C=CC(=C1)NC(=O)N)Br Z198194748 [0,2,0,0,0,0|0,1,0]=3 756 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,2,0,0,0,0|1,1,0]=4 757 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Br)F Z1263540637 [0,2,0,0,0,0|0,1,0]=3 758 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Cl)N Z239124000 [0,2,0,0,0,0|0,1,0]=3 759 B12R1.19 NC(=O)NC1=CC(=C(C=C1)F)Cl Z198194754 [0,2,0,0,0,0|0,1,0]=3 760 B12R1.19 NC(=S)NC1=CC(=C(C=C1)F)Cl Z56923300 [0,2,0,0,0,0|0,0,0]=2 761 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N Z147641478 [0,2,0,0,0,0|1,1,0]=4 762 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [0,2,0,0,0,0|1,1,0]=4 763 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [0,2,0,0,0,0|0,1,0]=3 764 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [0,2,0,0,0,0|1,1,0]=4 765 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [0,2,0,0,0,0|1,1,0]=4 766 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [0,2,0,0,0,0|1,1,0]=4 767 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [0,2,0,0,0,0|1,1,0]=4 768 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [0,2,0,0,0,0|1,1,0]=4 769 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Br Z381016676 [0,2,0,0,0,0|1,1,0]=4 770 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)C Z440633654 [0,2,0,0,0,0|1,1,0]=4 771 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)Cl Z440633664 [0,2,0,0,0,0|1,1,0]=4 772 B12R1.49 C=CC(=O)NC1=CC=C(C=C1)F Z424770410 [0,2,0,0,0,0|1,1,0]=4 773 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [0,2,0,0,0,0|1,1,0]=4 774 B12R1.49 CC1=CC=C(C=C1)NC(=O)CCl Z56862730 [0,2,0,0,0,0|1,1,0]=4 775 B12R1.49 CC1=CC=C(C=C1)NC(=O)CO Z228585410 [0,2,0,0,0,0|1,1,0]=4 776 B12R1.49 CC1=CC=C(C=C1)NC(=S)NN Z56813496 [0,2,0,0,0,0|0,0,0]=2 777 B12R1.49 CCC(=O)NC1=CC=C(C=C1)F Z27805867 [0,2,0,0,0,0|1,1,0]=4 778 B12R1.49 CCC(=O)NC1=CC=C(C=C1)I Z30316420 [0,2,0,0,0,0|1,1,0]=4 779 B12R1.49 CCC(=O)NC1=CC=C(C=C1)N Z432066898 [0,2,0,0,0,0|1,1,0]=4 780 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [0,2,0,0,0,0|1,1,0]=4 781 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [0,2,0,0,0,0|1,1,0]=4 782 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [0,2,0,0,0,0|1,1,0]=4 783 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [0,2,0,0,0,0|1,1,0]=4 784 B12R1.49 CNC(=O)NC1=CC=C(C=C1)Cl Z55293750 [0,2,0,0,0,0|0,1,0]=3 785 B12R1.49 CNC(=O)NC1=CC=C(C=C1)F Z55293762 [0,2,0,0,0,0|0,1,0]=3 786 B12R1.49 CNC(=O)NC1=CC=C(C=C1)N Z246671880 [0,2,0,0,0,0|0,1,0]=3 787 B12R1.49 COC(=O)NC1=CC=C(C=C1)Br Z56758690 [0,2,0,0,0,0|1,1,0]=4 788 B12R1.49 COC(=O)NC1=CC=C(C=C1)N Z319610150 [0,2,0,0,0,0|1,1,0]=4 789 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [0,2,0,0,0,0|1,1,0]=4 790 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [0,2,0,0,0,0|1,1,0]=4 791 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Br Z594272012 [0,2,0,0,0,0|0,1,0]=3 792 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Cl Z803145238 [0,2,0,0,0,0|0,1,0]=3 793 B12R1.49 NCC(=O)NC1=CC=C(C=C1)N Z2895972079 [0,2,0,0,0,0|0,1,0]=3 794 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [0,2,0,0,0,0|0,1,0]=3 795 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl Z56346881 [0,2,0,0,0,0|1,1,0]=4 796 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [0,2,0,0,0,0|1,1,0]=4 797 B12R1.49 NNC(=S)NC1=CC=C(C=C1)Cl Z56828393 [0,2,0,0,0,0|0,0,0]=2 798 B12R1.49 NNC(=S)NC1=CC=C(C=C1)F Z56828392 [0,2,0,0,0,0|0,0,0]=2 799 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [0,2,0,0,0,0|1,1,0]=4 800 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [0,2,0,0,0,0|1,1,0]=4 801 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [0,2,0,0,0,0|1,1,0]=4 802 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [0,2,0,0,0,0|1,1,0]=4 803 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Br Z56899212 [0,2,0,0,0,0|1,1,0]=4 804 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Cl Z56867253 [0,2,0,0,0,0|1,1,0]=4 805 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)F Z56755193 [0,2,0,0,0,0|1,1,0]=4 806 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)I Z56869425 [0,2,0,0,0,0|1,1,0]=4 807 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [0,2,0,0,0,0|1,1,0]=4 808 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl Z228585484 [0,2,0,0,0,0|1,1,0]=4 809 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)Br Z295879634 [0,2,0,0,0,0|1,1,0]=4 810 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)Cl Z1612297151 [0,2,0,0,0,0|1,1,0]=4 811 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)F Z1612297177 [0,2,0,0,0,0|1,1,0]=4 812 B12R1.106 NS(=O)(=O)NC1=CC=C(C=C1)O Z335810542 [0,2,0,0,0,0|1,1,0]=4 813 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)C Z26621747 [0,2,0,0,0,0|1,1,0]=4 814 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)Cl Z29819536 [0,2,0,0,0,0|1,1,0]=4 815 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)F Z30824336 [0,2,0,0,0,0|1,1,0]=4 816 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)N Z362832080 [0,2,0,0,0,0|1,1,0]=4 817 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)Br Z26522737 [0,2,0,0,0,0|1,1,0]=4 818 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)C Z27801599 [0,2,0,0,0,0|1,1,0]=4 819 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)N Z274782976 [0,2,0,0,0,0|1,1,0]=4 820 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)O Z33451994 [0,2,0,0,0,0|1,1,0]=4 821 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Cl)N Z239120680 [0,2,0,0,0,0|1,1,0]=4 822 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)Br Z361888984 [0,2,0,0,0,0|1,1,0]=4 823 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)C Z29827980 [0,2,0,0,0,0|1,1,0]=4 824 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)F Z30802596 [0,2,0,0,0,0|1,1,0]=4 825 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)C Z30179236 [0,2,0,0,0,0|1,1,0]=4 826 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)Cl Z394383940 [0,2,0,0,0,0|1,1,0]=4 827 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)C Z239121088 [0,2,0,0,0,0|1,1,0]=4 828 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)Cl Z223844400 [0,2,0,0,0,0|1,1,0]=4 829 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [0,2,0,0,0,0|1,1,0]=4 830 B12R1.233 CC1=CC(=C(C=C1)NC(=O)N)C Z56754685 [0,2,0,0,0,0|0,1,0]=3 831 B12R1.233 CC1=CC(=C(C=C1)NC(=O)N)F Z359376242 [0,2,0,0,0,0|0,1,0]=3 832 B12R1.233 N=C(N)CC1=C(C=C(C=C1)F)F Z1642389901 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.233 N=C(N)NC1=C(C=C(C=C1)F)F Z2235390716 [0,2,0,0,0,0|1,0,0]=3 834 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [0,2,0,0,0,0|1,1,0]=4 835 B12R1.233 NC(=O)NC1=C(C=C(C=C1)I)Br Z1352765519 [0,2,0,0,0,0|0,1,0]=3 836 B12R1.233 NC(=S)NC1=C(C=C(C=C1)F)F Z271134310 [0,2,0,0,0,0|0,0,0]=2 837 B12R1.34 C=CC(=O)N(C)C1=CC=CC=C1 Z440633576 [0,2,0,0,0,0|1,1,0]=4 838 B12R1.34 CC(CN)N(C)C1=CC=CC=C1 Z228572562 [0,2,0,0,0,0|1,0,1]=4 839 B12R1.34 CCC(=O)N(C)C1=CC=CC=C1 Z58322425 [0,2,0,0,0,0|1,1,0]=4 840 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 Z56896212 [0,2,0,0,0,0|1,1,0]=4 841 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 Z594038166 [0,2,0,0,0,0|1,1,0]=4 842 B12R1.34 CNC(=O)C(O)C1=CC=CC=C1 Z1203869997 [0,2,0,0,0,0|1,1,0]=4 843 B12R1.34 CSC(=S)N(C)C1=NC=CC=C1 Z56837011 [0,2,0,0,0,0|2,0,0]=4 844 B12R1.225 CC(=O)N(C)C1=CC(=CC=C1)N Z802628524 [0,2,0,0,0,0|1,1,0]=4 845 B12R1.225 CN(C(=O)N)C1=CC(=CC=C1)N Z802629090 [0,2,0,0,0,0|0,1,0]=3 846 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [0,2,0,0,0,0|1,1,0]=4 847 B12R1.253 CC(N)(C(=O)N)C1=CC=CC=C1 Z1211228973 [0,2,0,0,0,0|1,1,0]=4 848 B12R1.253 CC(O)(C(=N)N)C1=CC=CC=C1 Z1723549308 [0,2,0,0,0,0|2,0,0]=4 849 B12R1.253 NC(=O)C(F)(F)C1=CC=CC=C1 Z56757372 [0,2,0,0,0,0|1,1,0]=4 850 B12R1.478 CCN(C(=O)C)C1=CC=CC=C1 Z58324632 [0,2,0,0,0,0|1,1,0]=4 851 B12R1.564 CN(C1=CC=CC=C1)S(=O)(=O)N Z300101164 [0,2,0,0,0,0|1,1,0]=4 852 B12R1.32 CC#CC(=O)NC1=CC=CC=C1 Z1509183430 [0,2,0,0,0,0|1,1,0]=4 853 B12R1.32 CCNC(=O)NC1=CC=CC=C1 Z44586347 [0,2,0,0,0,0|0,1,0]=3 854 B12R1.32 CCNC(=O)NC1=CN=CC=C1 Z44592359 [0,2,0,0,0,0|1,1,0]=4 855 B12R1.32 CNC/C(=C/C1=CC=CC=C1)/C Z1137726270 [0,2,0,0,0,0|2,0,0]=4 856 B12R1.32 CNCC(=O)NC1=CC=CC=C1 Z380844554 [0,2,0,0,0,0|0,1,0]=3 857 B12R1.32 CNCC(=O)NC1=CC=NC=C1 Z1459449253 [0,2,0,0,0,0|1,1,0]=4 858 B12R1.32 COCC(=O)NC1=CC=CC=C1 Z31504642 [0,2,0,0,0,0|1,1,0]=4 859 B12R1.32 CSCC(=O)NC1=CC=CC=C1 Z27781929 [0,2,0,0,0,0|1,0,1]=4 860 B12R1.32 N#CCC(=O)NC1=CC=CC=C1 Z56813510 [0,2,0,0,0,0|0,1,1]=4 861 B12R1.32 NCCC(=O)NC1=CC=CC=C1 Z241054028 [0,2,0,0,0,0|0,1,0]=3 862 B12R1.32 NCCC(=O)NC1=CC=NC=C1 Z992716916 [0,2,0,0,0,0|1,1,0]=4 863 B12R1.32 NCCC(=O)NC1=CN=CC=C1 Z1101435045 [0,2,0,0,0,0|1,1,0]=4 864 B12R1.32 NCCC(=O)NC1=NC=CC=C1 Z398557256 [0,2,0,0,0,0|1,1,0]=4 865 B12R1.32 O=C(/C=N/O)NC1=CC=CC=C1 Z56871811 [0,2,0,0,0,0|0,1,1]=4 866 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 Z217707130 [0,2,0,0,0,0|1,1,0]=4 867 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Br Z381016842 [0,2,0,0,0,0|1,1,0]=4 868 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)C Z440633644 [0,2,0,0,0,0|1,1,0]=4 869 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)Cl Z440633660 [0,2,0,0,0,0|1,1,0]=4 870 B12R1.50 C=CC(=O)NC1=CC=CC(=C1)F Z440633662 [0,2,0,0,0,0|1,1,0]=4 871 B12R1.50 CC1=CC(=CC=C1)NC(=O)CCl Z56862383 [0,2,0,0,0,0|1,1,0]=4 872 B12R1.50 CC1=CC(=CC=C1)NC(=O)CO Z431952658 [0,2,0,0,0,0|1,1,0]=4 873 B12R1.50 CC1=CC(=CC=C1)NC(=S)NN Z56837059 [0,2,0,0,0,0|0,0,0]=2 874 B12R1.50 CCC(=O)NC1=CC(=CC=C1)Br Z27788979 [0,2,0,0,0,0|1,1,0]=4 875 B12R1.50 CCC(=O)NC1=CC(=CC=C1)F Z28143170 [0,2,0,0,0,0|1,1,0]=4 876 B12R1.50 CCC(=O)NC1=CC(=CC=C1)N Z57243699 [0,2,0,0,0,0|1,1,0]=4 877 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [0,2,0,0,0,0|1,1,0]=4 878 B12R1.50 CNC(=O)NC1=CC(=CC=C1)I Z177091564 [0,2,0,0,0,0|0,1,0]=3 879 B12R1.50 CNC(=O)NC1=CC(=CC=C1)N Z254059098 [0,2,0,0,0,0|0,1,0]=3 880 B12R1.50 CNC(=O)OC1=CC(=CC=C1)O Z1509352023 [0,2,0,0,0,0|1,1,0]=4 881 B12R1.50 CNC(=S)NC1=CC(=CC=C1)C Z45796896 [0,2,0,0,0,0|0,0,0]=2 882 B12R1.50 COC(=O)NC1=CC(=CC=C1)C Z371333120 [0,2,0,0,0,0|1,1,0]=4 883 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl Z56754690 [0,2,0,0,0,0|1,1,0]=4 884 B12R1.50 COC(=O)NC1=CC(=CC=C1)N Z319610162 [0,2,0,0,0,0|1,1,0]=4 885 B12R1.50 COC(=O)NC1=CC(=CC=C1)O Z335810160 [0,2,0,0,0,0|1,1,0]=4 886 B12R1.50 NC1=CC(=CC=C1)NC(=O)CO Z385458324 [0,2,0,0,0,0|1,1,0]=4 887 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [0,2,0,0,0,0|1,1,0]=4 888 B12R1.50 NCC(=O)NC1=CC(=CC=C1)Br Z46280185 [0,2,0,0,0,0|0,1,0]=3 889 B12R1.50 NCC(=O)NC1=CC(=CC=C1)F Z46280394 [0,2,0,0,0,0|0,1,0]=3 890 B12R1.50 NNC(=S)NC1=CC(=CC=C1)Br Z111871260 [0,2,0,0,0,0|0,0,0]=2 891 B12R1.50 NNC(=S)NC1=CC(=CC=C1)Cl Z56862329 [0,2,0,0,0,0|0,0,0]=2 892 B12R1.50 O=C(CC1=CC(=CC=C1)F)NO Z59182830 [0,2,0,0,0,0|1,1,0]=4 893 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [0,2,0,0,0,0|1,1,0]=4 894 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Br Z56896266 [0,2,0,0,0,0|1,1,0]=4 895 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Cl Z56869410 [0,2,0,0,0,0|1,1,0]=4 896 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)I Z56824475 [0,2,0,0,0,0|1,1,0]=4 897 B12R1.50 O=C(CCl)NC1=CC=CC(=C1)F Z56889137 [0,2,0,0,0,0|1,1,0]=4 898 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)C Z440633758 [0,2,0,0,0,0|1,1,0]=4 899 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)Cl Z440633680 [0,2,0,0,0,0|1,1,0]=4 900 B12R1.371 C=CC(=O)NC1=C(C=CC=C1)F Z295390598 [0,2,0,0,0,0|1,1,0]=4 901 B12R1.371 CC1=C(C=CC=C1)NC(=O)CCl Z56896310 [0,2,0,0,0,0|1,1,0]=4 902 B12R1.371 CC1=C(C=CC=C1)NC(=O)CO Z228585408 [0,2,0,0,0,0|1,1,0]=4 903 B12R1.371 CC1=C(C=CC=C1)NC(=O)NN Z381337818 [0,2,0,0,0,0|0,1,0]=3 904 B12R1.371 CC1=C(C=CC=C1)NC(=S)NN Z56813493 [0,2,0,0,0,0|0,0,0]=2 905 B12R1.371 CCC(=O)NC1=C(C=CC=C1)Br Z27784757 [0,2,0,0,0,0|1,1,0]=4 906 B12R1.371 CCC(=O)NC1=C(C=CC=C1)F Z28290312 [0,2,0,0,0,0|1,1,0]=4 907 B12R1.371 CCC(=O)NC1=C(C=CC=C1)O Z68195027 [0,2,0,0,0,0|1,1,0]=4 908 B12R1.371 CNC(=O)CC1=C(C=CC=C1)N Z234895127 [0,2,0,0,0,0|1,1,0]=4 909 B12R1.371 CNC(=O)NC1=C(C=CC=C1)Br Z371866552 [0,2,0,0,0,0|0,1,0]=3 910 B12R1.371 CNC(=O)NC1=C(C=CC=C1)F Z55293757 [0,2,0,0,0,0|0,1,0]=3 911 B12R1.371 CNC(=O)NC1=C(C=CC=C1)I Z371866768 [0,2,0,0,0,0|0,1,0]=3 912 B12R1.371 CNC(=O)NC1=C(C=CC=N1)C Z513568264 [0,2,0,0,0,0|1,1,0]=4 913 B12R1.371 CNC(=S)NC1=C(N=CC=C1)Cl Z45824154 [0,2,0,0,0,0|1,0,0]=3 914 B12R1.371 COC(=O)NC1=C(C=CC=C1)O Z425822036 [0,2,0,0,0,0|1,1,0]=4 915 B12R1.371 N/C(=N\O)/CC1=C(C=CC=C1)Cl Z451350216 [0,2,0,0,0,0|1,1,0]=4 916 B12R1.371 NCC(=O)NC1=C(C=CC=C1)Br Z56964583 [0,2,0,0,0,0|0,1,0]=3 917 B12R1.371 NCC(=O)NC1=C(C=CC=C1)F Z1449752250 [0,2,0,0,0,0|0,1,0]=3 918 B12R1.371 NNC(=S)NC1=C(C=CC=C1)Cl Z56828391 [0,2,0,0,0,0|0,0,0]=2 919 B12R1.371 NNC(=S)NC1=C(C=CC=C1)F Z56813485 [0,2,0,0,0,0|0,0,0]=2 920 B12R1.371 O=C(CC1=C(C=CC=C1)Cl)NO Z59182782 [0,2,0,0,0,0|1,1,0]=4 921 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)Br Z56813048 [0,2,0,0,0,0|1,1,0]=4 922 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)Cl Z56821911 [0,2,0,0,0,0|1,1,0]=4 923 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)F Z56869396 [0,2,0,0,0,0|1,1,0]=4 924 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)I Z55992882 [0,2,0,0,0,0|1,1,0]=4 925 B12R1.371 O=C(CCl)NC1=C(C=CC=C1)O Z57764509 [0,2,0,0,0,0|1,1,0]=4 926 B12R1.75 C#CC1=C(C=CC=C1)CC(=O)N Z1262691146 [0,2,0,0,0,0|1,1,0]=4 927 B12R1.75 CC(=O)NC1=C(C=CC=C1)C#N Z26489157 [0,2,0,0,0,0|1,1,0]=4 928 B12R1.75 CC(=O)NC1=C(C=CC=C1)C=O Z1143235775 [0,2,0,0,0,0|1,1,0]=4 929 B12R1.75 COC1=C(C=CC=C1)CC(=O)N Z33545381 [0,2,0,0,0,0|1,1,0]=4 930 B12R1.75 COC1=C(C=CC=C1)NC(=O)C Z27797377 [0,2,0,0,0,0|1,1,0]=4 931 B12R1.75 COC1=C(C=CC=C1)NC(=O)N Z56754689 [0,2,0,0,0,0|0,1,0]=3 932 B12R1.75 CSC1=C(C=CC=C1)NC(=O)C Z26434950 [0,2,0,0,0,0|1,1,0]=4 933 B12R1.75 N#CC1=C(C=CC=C1)NC(=O)N Z228365404 [0,2,0,0,0,0|0,1,0]=3 934 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)C Z448251216 [0,2,0,0,0,0|1,1,0]=4 935 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)Cl Z1037552282 [0,2,0,0,0,0|1,1,0]=4 936 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Br Z56827897 [0,2,0,0,0,0|1,1,0]=4 937 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Cl Z276567178 [0,2,0,0,0,0|1,1,0]=4 938 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)C Z27065719 [0,2,0,0,0,0|1,1,0]=4 939 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)Cl Z28136791 [0,2,0,0,0,0|1,1,0]=4 940 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)N Z239121632 [0,2,0,0,0,0|1,1,0]=4 941 B12R1.127 CC(=O)NC1=C(C=CC(=C1)F)C Z30904143 [0,2,0,0,0,0|1,1,0]=4 942 B12R1.127 CC(=O)NC1=C(C=CC(=C1)I)Cl Z1408462342 [0,2,0,0,0,0|1,1,0]=4 943 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)C Z239120816 [0,2,0,0,0,0|1,1,0]=4 944 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)Cl Z431580096 [0,2,0,0,0,0|1,1,0]=4 945 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)F Z235362233 [0,2,0,0,0,0|1,1,0]=4 946 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)O Z1198342725 [0,2,0,0,0,0|1,1,0]=4 947 B12R1.127 CC1=C(C=C(C=C1)Br)NC(=O)N Z448250040 [0,2,0,0,0,0|0,1,0]=3 948 B12R1.127 CC1=CC(=C(C=C1)C)NC(=O)N Z56754686 [0,2,0,0,0,0|0,1,0]=3 949 B12R1.127 CC1=CC(=C(C=C1)C)NC(=S)N Z56923302 [0,2,0,0,0,0|0,0,0]=2 950 B12R1.127 CC1=CC(=C(C=C1)F)NC(=S)N Z367660514 [0,2,0,0,0,0|0,0,0]=2 951 B12R1.127 NC(=O)NC1=C(C=CC(=C1)I)Cl Z1410208208 [0,2,0,0,0,0|0,1,0]=3 952 B12R1.127 NC(=O)NC1=C(C=CC(=C1)N)F Z239123692 [0,2,0,0,0,0|0,1,0]=3 953 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Br)Cl Z2017822392 [0,2,0,0,0,0|1,1,0]=4 954 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Cl)C Z28292377 [0,2,0,0,0,0|1,1,0]=4 955 B12R1.224 CC(=O)NC1=C(C(=CC=C1)N)C Z239122448 [0,2,0,0,0,0|1,1,0]=4 956 B12R1.224 CC1=C(C(=CC=C1)NC(=O)N)C Z107732968 [0,2,0,0,0,0|0,1,0]=3 957 B12R1.224 CC1=C(C=CC=C1I)NC(=O)N Z1638019250 [0,2,0,0,0,0|0,1,0]=3 958 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [0,2,0,0,0,0|1,1,0]=4 959 B12R1.224 NC(=O)NC1=C(C(=CC=C1)Cl)Br Z1837227078 [0,2,0,0,0,0|0,1,0]=3 960 B12R1.224 NC(=O)NC1=C(C(=CC=C1)F)Cl Z2114437375 [0,2,0,0,0,0|0,1,0]=3 961 B12R1.224 NC(=O)NC1=C(C(=CN=C1)Br)Cl Z1620665681 [0,2,0,0,0,0|1,1,0]=4 962 B12R1.1009 CC1=CC=CC(=C1NC(=S)N)C Z56960307 [0,2,0,0,0,0|0,0,0]=2 963 B12R1.1009 N=C(N)CC1=C(C=CC=C1Cl)Cl Z1708089988 [0,2,0,0,0,0|2,0,0]=4 964 B12R1.1009 N=C(N)CC1=C(C=CC=C1F)Cl Z1695906722 [0,2,0,0,0,0|2,0,0]=4 965 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl Z33546774 [0,2,0,0,0,0|1,1,0]=4 966 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)Cl Z33546661 [0,2,0,0,0,0|1,1,0]=4 967 B12R1.1009 NC(=O)CC1=C(C=CC=C1F)F Z1389112660 [0,2,0,0,0,0|1,1,0]=4 968 B12R1.1009 NC(=O)NC1=C(C=CC=C1Cl)Cl Z1263622729 [0,2,0,0,0,0|0,1,0]=3 969 B12R1.101 CC(=O)NC1=CC(=CC(=C1)C)C Z30889668 [0,2,0,0,0,0|1,1,0]=4 970 B12R1.101 CC(=O)NC1=CC(=CC(=C1)Cl)Cl Z30181347 [0,2,0,0,0,0|1,1,0]=4 971 B12R1.101 CC(=O)NC1=CC(=CC(=C1)I)I Z2078739597 [0,2,0,0,0,0|1,1,0]=4 972 B12R1.101 CC1=CC(=CC(=C1)F)NC(=O)N Z1295850516 [0,2,0,0,0,0|0,1,0]=3 973 B12R1.101 CC1=CC(=CC(=C1)NC(=S)N)C Z56933788 [0,2,0,0,0,0|0,0,0]=2 974 B12R1.101 CC1=CC(=NC(=N1)NC(=S)N)C Z56872040 [0,2,0,0,0,0|2,0,0]=4 975 B12R1.101 NC(=O)NC1=CC(=CC(=C1)F)F Z198195676 [0,2,0,0,0,0|0,1,0]=3 976 B12R1.119 NC1=CC(=CC=C1)NS(=O)(=O)N Z295879120 [0,2,0,0,0,0|1,1,0]=4 977 B12R1.438 C#CC1=CC=CC(=C1)NC(=O)N Z316107698 [0,2,0,0,0,0|0,1,0]=3 978 B12R1.438 CC(=O)NC1=CC(=CC=C1)C#N Z26548069 [0,2,0,0,0,0|1,1,0]=4 979 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O Z1238570824 [0,2,0,0,0,0|1,1,0]=4 980 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN Z239097364 [0,2,0,0,0,0|1,1,0]=4 981 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [0,2,0,0,0,0|1,1,0]=4 982 B12R1.438 CCC1=CC(=CC=C1)NC(=N)N Z2518173555 [0,2,0,0,0,0|1,0,0]=3 983 B12R1.438 CCC1=CC(=CC=C1)NC(=S)N Z271134332 [0,2,0,0,0,0|0,0,0]=2 984 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [0,2,0,0,0,0|2,0,0]=4 985 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [0,2,0,0,0,0|1,1,0]=4 986 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [0,2,0,0,0,0|1,1,0]=4 987 B12R1.438 COC1=CC(=CC=C1)NC(=S)N Z56913186 [0,2,0,0,0,0|0,0,0]=2 988 B12R1.438 NCC1=CC(=CC=C1)NC(=O)N Z228589074 [0,2,0,0,0,0|0,1,0]=3 989 B10R1.66 NC(=S)NCC1=CC=CO1 Z56943723 [0,0,1,1,0,0|1,0,1]=4 990 B10R1.66 NC(=S)NCC1=CC=CS1 Z404001698 [0,0,1,1,0,0|1,0,1]=4 991 B10R2.7 C1=CC2=C(C=C1)CC=C2 Z104476162 [1,0,0,1,0,0|2,0,0]=4 992 B10R2.7 C1=CC2=C(C=C1)NC=C2 Z57833933 [1,0,0,1,0,0|1,0,0]=3 993 B10R2.7 C1=CC2=C(C=C1)NC=N2 Z57069879 [1,0,0,1,0,0|0,0,1]=3 994 B10R2.7 C1=CC2=C(C=C1)NCC2 Z104475582 [1,0,0,1,0,0|1,0,1]=4 995 B10R2.7 C1=CC2=C(C=C1)NN=C2 Z276614452 [1,0,0,1,0,0|2,0,0]=4 996 B10R2.7 C1=CC2=C(C=C1)NN=N2 Z57127352 [1,0,0,1,0,0|1,0,1]=4 997 B10R2.7 C1=CC2=C(C=C1)OC=C2 Z56347207 [1,0,0,1,0,0|1,1,0]=4 998 B10R2.7 C1=CC2=C(C=C1)SC=C2 Z370711590 [1,0,0,1,0,0|1,0,1]=4 999 B10R2.7 C1=CC2=C(C=C1)SC=N2 Z104472964 [1,0,0,1,0,0|0,0,2]=4 1000 B10R2.7 C1=CC2=C(C=CN2)C=N1 Z1079456082 [1,0,0,1,0,0|2,0,0]=4 1001 B10R2.7 C1=CC2=C(C=N1)NC=C2 Z871773918 [1,0,0,1,0,0|2,0,0]=4 1002 B10R2.7 C1=CC2=C(C=N1)NC=N2 Z1117890443 [1,0,0,1,0,0|1,0,1]=4 1003 B10R2.7 C1=CC2=C(N=C1)NC=C2 Z271099378 [1,0,0,1,0,0|2,0,0]=4 1004 B10R2.7 C1=CC2=C(N=C1)NC=N2 Z276130126 [1,0,0,1,0,0|1,0,1]=4 1005 B10R2.320 NC1CC2=C1C=CC=C2 Z1918018858 [1,0,0,1,0,0|1,0,1]=4 1006 B12R2.22 O=C1CC(N1)C2=CC=CC=C2 Z367677412 [0,0,0,1,0,1|1,1,0]=4 1007 B12R2.24 CC1CNC2=C(N1)C=CC=C2 Z1203731025 [0,0,0,1,0,1|1,0,1]=4 1008 B12R2.24 NC1=CC2=C(C=CC=C2)C=C1 Z104494980 [0,0,0,1,0,1|2,0,0]=4 1009 B12R2.24 NC1=CC2=C(C=CC=C2)N=C1 Z234895085 [0,0,0,1,0,1|1,0,1]=4 1010 B12R2.24 NC1=NC2=C(C=CC=C2)C=C1 Z56347237 [0,0,0,1,0,1|2,0,0]=4 1011 B12R2.24 NC1=NC2=C(C=CC=C2)CS1 Z1198725303 [0,0,0,1,0,1|2,0,0]=4 1012 B12R2.24 NC1=NC2=C(C=CC=C2)N=C1 Z979455432 [0,0,0,1,0,1|1,0,1]=4 1013 B12R2.24 NC1=NC2=C(C=CC=C2)N=N1 Z57724710 [0,0,0,1,0,1|1,0,1]=4 1014 B12R2.24 NC1=NC=C2C=CC=CC2=C1 Z1201619117 [0,0,0,1,0,1|1,0,1]=4 1015 B12R2.24 NC1=NN=C2C=CC=CC2=C1 Z1198155761 [0,0,0,1,0,1|1,0,1]=4 1016 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Z1203731786 [0,0,0,1,0,1|1,1,0]=4 1017 B12R2.24 O=C1C=CC2=C(N1)C=CC=C2 Z57473020 [0,0,0,1,0,1|1,1,0]=4 1018 B12R2.24 O=C1C=NC2=C(N1)C=CC=C2 Z56824051 [0,0,0,1,0,1|0,1,1]=4 1019 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 Z1201622353 [0,0,0,1,0,1|1,1,0]=4 1020 B12R2.24 O=C1CCC2=C(N1)C=CC=C2 Z85917566 [0,0,0,1,0,1|1,1,0]=4 1021 B12R2.24 O=C1CNC2=C(N1)C=CC=C2 Z56990723 [0,0,0,1,0,1|0,1,0]=3 1022 B12R2.24 O=C1CNC2=C(N1)C=CC=N2 Z1142668508 [0,0,0,1,0,1|1,1,0]=4 1023 B12R2.24 O=C1CNC2=C(N1)C=NC=C2 Z916962704 [0,0,0,1,0,1|1,1,0]=4 1024 B12R2.24 O=C1COC2=C(N1)C=CC=C2 Z56989567 [0,0,0,1,0,1|1,1,0]=4 1025 B12R2.24 O=C1CSC2=C(N1)C=CC=C2 Z55120717 [0,0,0,1,0,1|1,1,0]=4 1026 B12R2.24 O=C1N=CC2=C(N1)C=CC=C2 Z1198176626 [0,0,0,1,0,1|0,1,1]=4 1027 B12R2.24 O=C1NC2=C(C=CC=C2)CO1 Z1198157416 [0,0,0,1,0,1|1,1,0]=4 1028 B12R2.24 O=C1NCC2=C(N1)C=NC=C2 Z4560521307 [0,0,0,1,0,1|1,1,0]=4 1029 B12R2.24 O=C1NCC2=C(O1)C=CC=C2 Z1198723657 [0,0,0,1,0,1|1,1,0]=4 1030 B12R2.24 S=C1NC2=C(C=CC=C2)CS1 Z367678726 [0,0,0,1,0,1|1,0,0]=3 1031 B12R2.3190 N=C(N)C1CC2=C1C=CC=C2 Z1613477992 [0,0,0,1,0,1|2,0,0]=4 1032 B12R2.1041 O=C1N=C2C=CC=CC=C2N1 Z1509141704 [0,0,0,1,0,1|0,1,1]=4 1033 B12R2.606 CC1=CC2=C(C=C1)N=C(N2)N Z995046368 [0,1,0,1,0,0|1,0,0]=3 1034 B12R2.606 CC1=CC2=C(C=C1)N=C(O2)N Z979487656 [0,1,0,1,0,0|0,1,1]=4 1035 B12R2.606 CC1=CC2=C(C=C1)N=C(S2)N Z57069881 [0,1,0,1,0,0|0,0,2]=4 1036 B12R2.606 CC1=CC2=C(C=C1)NC(=N)C2 Z4603464626 [0,1,0,1,0,0|1,0,1]=4 1037 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)C Z57370047 [0,1,0,1,0,0|1,0,1]=4 1038 B12R2.606 CC1=CC2=C(C=C1)NC(=N2)S Z57298378 [0,1,0,1,0,0|0,0,2]=4 1039 B12R2.606 CC1=CC2=C(C=C1)OC(=O)N2 Z274568258 [0,1,0,1,0,0|1,1,0]=4 1040 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)Br Z1269196919 [0,1,0,1,0,0|2,0,0]=4 1041 B12R2.606 CC1=CC2=C(N1)C=C(C=C2)F Z1201624894 [0,1,0,1,0,0|2,0,0]=4 1042 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)F Z1203162476 [0,1,0,1,0,0|2,0,0]=4 1043 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)N Z361880768 [0,1,0,1,0,0|2,0,0]=4 1044 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [0,1,0,1,0,0|2,0,0]=4 1045 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)Br Z382823070 [0,1,0,1,0,0|1,0,1]=4 1046 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [0,1,0,1,0,0|1,0,1]=4 1047 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [0,1,0,1,0,0|1,1,0]=4 1048 B12R2.606 NC1=CC2=C(C=C1)N=C(S2)N Z2289761601 [0,1,0,1,0,0|0,0,2]=4 1049 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [0,1,0,1,0,0|1,1,0]=4 1050 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 Z56793257 [0,1,0,1,0,0|0,1,0]=3 1051 B12R2.606 NC1=CC2=C(C=C1)NC(=O)S2 Z1270210776 [0,1,0,1,0,0|1,0,1]=4 1052 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 Z56944506 [0,1,0,1,0,0|1,1,0]=4 1053 B12R2.606 NC1=NC2=C(N1)C=C(C=N2)Br Z2218555937 [0,1,0,1,0,0|2,0,0]=4 1054 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Br Z1270207960 [0,1,0,1,0,0|1,0,0]=3 1055 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)Cl Z995046354 [0,1,0,1,0,0|1,0,0]=3 1056 B12R2.606 NC1=NC2=C(N1)C=CC(=C2)I Z1269176820 [0,1,0,1,0,0|1,0,0]=3 1057 B12R2.606 NC1=NC2=C(N1)N=CC(=C2)Cl Z4459684100 [0,1,0,1,0,0|2,0,0]=4 1058 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)Br Z1269173847 [0,1,0,1,0,0|0,1,1]=4 1059 B12R2.606 NC1=NC2=C(O1)C=C(C=C2)F Z1147226282 [0,1,0,1,0,0|0,1,1]=4 1060 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Br Z359373114 [0,1,0,1,0,0|0,1,1]=4 1061 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)Cl Z89267039 [0,1,0,1,0,0|0,1,1]=4 1062 B12R2.606 NC1=NC2=C(O1)C=CC(=C2)F Z979487600 [0,1,0,1,0,0|0,1,1]=4 1063 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Br Z56858257 [0,1,0,1,0,0|0,0,2]=4 1064 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)Cl Z56896352 [0,1,0,1,0,0|0,0,2]=4 1065 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)F Z56899125 [0,1,0,1,0,0|0,0,2]=4 1066 B12R2.606 NC1=NC2=C(S1)C=C(C=C2)I Z1741785969 [0,1,0,1,0,0|0,0,2]=4 1067 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)Cl Z228584306 [0,1,0,1,0,0|0,0,2]=4 1068 B12R2.606 NC1=NC2=C(S1)C=CC(=C2)O Z1198155943 [0,1,0,1,0,0|0,0,2]=4 1069 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [0,1,0,1,0,0|1,1,0]=4 1070 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [0,1,0,1,0,0|1,1,0]=4 1071 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [0,1,0,1,0,0|1,1,0]=4 1072 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [0,1,0,1,0,0|1,1,0]=4 1073 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [0,1,0,1,0,0|1,1,0]=4 1074 B12R2.606 O=C1NC2=C(N1)C=C(C=C2)F Z1198165756 [0,1,0,1,0,0|0,1,0]=3 1075 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Br Z381351238 [0,1,0,1,0,0|1,1,0]=4 1076 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)Cl Z99599674 [0,1,0,1,0,0|1,1,0]=4 1077 B12R2.606 O=C1NC2=C(O1)C=C(C=C2)I Z1269166325 [0,1,0,1,0,0|1,1,0]=4 1078 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Br Z979488024 [0,1,0,1,0,0|1,1,0]=4 1079 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)Cl Z57183224 [0,1,0,1,0,0|1,1,0]=4 1080 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)F Z979487984 [0,1,0,1,0,0|1,1,0]=4 1081 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [0,1,0,1,0,0|1,1,0]=4 1082 B12R2.606 O=C1NC2=C(S1)C=CC(=C2)F Z1198222395 [0,1,0,1,0,0|1,0,1]=4 1083 B12R2.606 SC1=NC2=C(N1)C=C(C=C2)Cl Z56921384 [0,1,0,1,0,0|0,0,2]=4 1084 B12R2.606 SC1=NC2=C(N1)C=CC(=C2)I Z3235033507 [0,1,0,1,0,0|0,0,2]=4 1085 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)Br Z361892264 [0,1,0,1,0,0|2,0,0]=4 1086 B12R2.18 CC1=C(C2=C(N1)C=CC=C2)C Z56867202 [0,1,0,1,0,0|2,0,0]=4 1087 B12R2.18 CC1=NC2=C(N1C)C=CC=C2 Z53833319 [0,1,0,1,0,0|1,0,1]=4 1088 B12R2.18 CC1=NC2=C(N1N)C=CC=C2 Z119919218 [0,1,0,1,0,0|1,0,1]=4 1089 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 Z425452744 [0,1,0,1,0,0|1,1,0]=4 1090 B12R2.18 CN1C(=CC2=C1C=CC=C2)N Z3243653956 [0,1,0,1,0,0|1,0,0]=3 1091 B12R2.18 CN1C(=N)SC2=C1C=CC=C2 Z56812812 [0,1,0,1,0,0|0,0,2]=4 1092 B12R2.18 CN1C(=NC2=C1C=CC=C2)Cl Z1198154841 [0,1,0,1,0,0|1,0,1]=4 1093 B12R2.18 CN1C(=NC2=C1C=CC=C2)S Z56891250 [0,1,0,1,0,0|0,0,2]=4 1094 B12R2.18 CN1C(=NC2=C1C=CC=N2)N Z1198163314 [0,1,0,1,0,0|2,0,0]=4 1095 B12R2.18 CN1C(=O)CC2=C1C=CC=C2 Z56899025 [0,1,0,1,0,0|1,1,0]=4 1096 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 Z57070418 [0,1,0,1,0,0|0,1,0]=3 1097 B12R2.18 CN1C(=O)NC2=C1C=CN=C2 Z1255402296 [0,1,0,1,0,0|1,1,0]=4 1098 B12R2.18 NC1=NC2=C(N1N)C=CC=C2 Z56788891 [0,1,0,1,0,0|1,0,0]=3 1099 B12R2.18 O=C1NC2=C(C1=O)C=CC=C2 Z57127903 [0,1,0,1,0,0|1,1,0]=4 1100 B12R2.18 O=C1NC2=C(C1O)C=CC=C2 Z335244966 [0,1,0,1,0,0|1,1,0]=4 1101 B12R2.18 O=C1NC2=C(N1O)C=CC=C2 Z1416184382 [0,1,0,1,0,0|0,1,0]=3 1102 B12R2.23 O=C1CCN1C2=CC=CC=C2 Z1198221109 [0,1,0,1,0,0|1,1,0]=4 1103 B12R2.32 CCC1=NC2=C(N1)C=CC=C2 Z55692907 [0,1,0,1,0,0|1,0,1]=4 1104 B12R2.32 CNC1=NC2=C(N1)C=CC=C2 Z56767838 [0,1,0,1,0,0|1,0,0]=3 1105 B12R2.32 CNC1=NC2=C(O1)C=CC=C2 Z235341203 [0,1,0,1,0,0|0,1,1]=4 1106 B12R2.32 CNC1=NC2=C(S1)C=CC=C2 Z235344695 [0,1,0,1,0,0|0,0,2]=4 1107 B12R2.32 CSC1=NC2=C(N1)C=CC=C2 Z53833331 [0,1,0,1,0,0|0,0,2]=4 1108 B12R2.32 ClCC1=NC2=C(N1)C=CC=C2 Z56943426 [0,1,0,1,0,0|1,0,1]=4 1109 B12R2.32 N#CC1=CC2=C(N1)C=CC=C2 Z1255419551 [0,1,0,1,0,0|1,0,1]=4 1110 B12R2.32 NCC1=CC2=C(N1)C=CC=C2 Z2106601624 [0,1,0,1,0,0|1,0,0]=3 1111 B12R2.32 NCC1=CC2=C(N1)C=CN=C2 Z2830496387 [0,1,0,1,0,0|2,0,0]=4 1112 B12R2.32 NCC1=CC2=C(N1)N=CC=C2 Z2310722918 [0,1,0,1,0,0|2,0,0]=4 1113 B12R2.32 NCC1=CC2=C(S1)C=CC=C2 Z57206121 [0,1,0,1,0,0|1,0,1]=4 1114 B12R2.32 NCC1=NC2=C(N1)C=CC=C2 Z104479710 [0,1,0,1,0,0|1,0,0]=3 1115 B12R2.32 NCC1=NC2=C(N1)N=CC=C2 Z1891776241 [0,1,0,1,0,0|2,0,0]=4 1116 B12R2.32 NCC1=NC2=C(O1)C=CC=C2 Z2106602610 [0,1,0,1,0,0|0,1,1]=4 1117 B12R2.32 NCC1=NC2=C(S1)C=CC=C2 Z166630948 [0,1,0,1,0,0|0,0,2]=4 1118 B12R2.32 NNC1=NC2=C(N1)C=CC=C2 Z57087494 [0,1,0,1,0,0|1,0,0]=3 1119 B12R2.32 NNC1=NC2=C(O1)C=CC=C2 Z56801289 [0,1,0,1,0,0|0,1,1]=4 1120 B12R2.32 NNC1=NC2=C(S1)C=CC=C2 Z56756340 [0,1,0,1,0,0|0,0,2]=4 1121 B12R2.32 O=CC1=CC2=C(N1)C=CC=C2 Z1203160203 [0,1,0,1,0,0|1,1,0]=4 1122 B12R2.32 O=CC1=NC2=C(N1)C=CC=C2 Z57114985 [0,1,0,1,0,0|0,1,1]=4 1123 B12R2.32 OCC1=NC2=C(N1)C=CC=C2 Z56791635 [0,1,0,1,0,0|0,1,1]=4 1124 B12R2.95 O=S1(=O)NC2=C(N1)C=CC=C2 Z321036532 [0,1,0,1,0,0|1,1,0]=4 1125 B12R2.202 CC1=C2N=C(NC2=CC=C1)N Z995046466 [0,1,0,1,0,0|1,0,0]=3 1126 B12R2.202 CC1=C2N=C(NC2=CC=C1)S Z596250516 [0,1,0,1,0,0|0,0,2]=4 1127 B12R2.202 CC1=C2N=C(SC2=CC=C1)N Z56174289 [0,1,0,1,0,0|0,0,2]=4 1128 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [0,1,0,1,0,0|1,1,0]=4 1129 B12R2.202 CC1=C2NC(=O)NC2=CC=C1 Z1198176895 [0,1,0,1,0,0|0,1,0]=3 1130 B12R2.202 CC1=C2NC(=O)NC2=NC=C1 Z1925930638 [0,1,0,1,0,0|1,1,0]=4 1131 B12R2.202 CC1=C2OC(=NC2=CC=C1)N Z1251362841 [0,1,0,1,0,0|0,1,1]=4 1132 B12R2.202 CC1=C2OC(=O)NC2=CC=C1 Z1255416550 [0,1,0,1,0,0|1,1,0]=4 1133 B12R2.202 CC1=C2SC(=NC2=CC=C1)N Z1262621975 [0,1,0,1,0,0|0,0,2]=4 1134 B12R2.202 CC1=C2SC(=O)NC2=CC=C1 Z1198222422 [0,1,0,1,0,0|1,0,1]=4 1135 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)C Z1198147838 [0,1,0,1,0,0|2,0,0]=4 1136 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)Cl Z1198221008 [0,1,0,1,0,0|2,0,0]=4 1137 B12R2.202 CC1=CC2=C(N1)C(=CC=C2)F Z1255418917 [0,1,0,1,0,0|2,0,0]=4 1138 B12R2.202 CC1=NC2=C(N1)C=CC=C2Br Z1269227518 [0,1,0,1,0,0|1,0,1]=4 1139 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [0,1,0,1,0,0|1,1,0]=4 1140 B12R2.202 NC1=C2NC(=O)NC2=CC=C1 Z1741972722 [0,1,0,1,0,0|0,1,0]=3 1141 B12R2.202 NC1=C2NC(=O)NC2=CC=N1 Z1255361083 [0,1,0,1,0,0|1,1,0]=4 1142 B12R2.202 NC1=C2OC(=O)NC2=CC=C1 Z1198223473 [0,1,0,1,0,0|1,1,0]=4 1143 B12R2.202 NC1=CC2=C(N1)C(=CC=C2)Br Z4503522928 [0,1,0,1,0,0|1,0,0]=3 1144 B12R2.202 NC1=CC2=C(N1)C=CC=C2Br Z4503522930 [0,1,0,1,0,0|1,0,0]=3 1145 B12R2.202 NC1=CC=CC2=C1NC(=N2)N Z1263620937 [0,1,0,1,0,0|1,0,0]=3 1146 B12R2.202 NC1=NC2=C(N1)C=CC=C2Br Z1269129228 [0,1,0,1,0,0|1,0,0]=3 1147 B12R2.202 NC1=NC2=C(O1)C(=CC=C2)Br Z1269218339 [0,1,0,1,0,0|0,1,1]=4 1148 B12R2.202 NC1=NC2=C(O1)C=CC=C2O Z1258981820 [0,1,0,1,0,0|0,1,1]=4 1149 B12R2.202 NC1=NC2=C(S1)C(=CC=C2)Br Z1269131394 [0,1,0,1,0,0|0,0,2]=4 1150 B12R2.202 NC1=NC2=C(S1)C=CC=C2Br Z2092369020 [0,1,0,1,0,0|0,0,2]=4 1151 B12R2.202 NC1=NC2=C(S1)C=CC=C2Cl Z57607000 [0,1,0,1,0,0|0,0,2]=4 1152 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [0,1,0,1,0,0|1,1,0]=4 1153 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [0,1,0,1,0,0|1,1,0]=4 1154 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [0,1,0,1,0,0|1,1,0]=4 1155 B12R2.202 O=C1NC2=C(C=CC=C2O1)Br Z1509211819 [0,1,0,1,0,0|1,1,0]=4 1156 B12R2.202 O=C1NC2=CC=CC(=C2N1)Br Z1269197007 [0,1,0,1,0,0|0,1,0]=3 1157 B12R2.202 O=C1NC2=CC=CC(=C2N1)F Z1575308465 [0,1,0,1,0,0|0,1,0]=3 1158 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [0,1,0,1,0,0|0,1,0]=3 1159 B12R2.202 O=C1NC2=CC=CC(=C2O1)Br Z1269211846 [0,1,0,1,0,0|1,1,0]=4 1160 B12R2.202 O=C1NC2=CC=CC(=C2O1)F Z1255387806 [0,1,0,1,0,0|1,1,0]=4 1161 B12R2.202 O=C1NC2=CC=CC(=C2S1)F Z1198222418 [0,1,0,1,0,0|1,0,1]=4 1162 B12R2.202 O=C1NC2=CN=CC(=C2N1)Br Z1269235386 [0,1,0,1,0,0|1,1,0]=4 1163 B12R2.202 OC1=NC2=C(N1)C=CC=C2Cl Z1245791555 [0,1,0,1,0,0|0,1,1]=4 1164 B8R1.7 N=C(N)C1=CC=CN1 Z4929337487 [0,0,0,0,2,0|2,0,0]=4 1165 B8R1.7 N=C(N)C1=CC=CO1 Z823287458 [0,0,0,0,2,0|2,0,0]=4 1166 B8R1.7 N=C(N)C1=CC=CS1 Z381357622 [0,0,0,0,2,0|2,0,0]=4 1167 B8R1.7 N=C(N)C1=COC=C1 Z3034283747 [0,0,0,0,2,0|2,0,0]=4 1168 B8R1.7 N=C(N)C1=CSC=C1 Z1266823180 [0,0,0,0,2,0|2,0,0]=4 1169 B8R1.7 NC(=O)C1=CC=CN1 Z135897752 [0,0,0,0,2,0|1,1,0]=4 1170 B8R1.7 NC(=O)C1=CC=CO1 Z33546471 [0,0,0,0,2,0|1,1,0]=4 1171 B8R1.7 NC(=O)C1=CC=CS1 Z33546758 [0,0,0,0,2,0|1,1,0]=4 1172 B8R1.7 NC(=O)C1=CNC=C1 Z1167406084 [0,0,0,0,2,0|1,1,0]=4 1173 B8R1.7 NC(=O)C1=COC=C1 Z168362720 [0,0,0,0,2,0|1,1,0]=4 1174 B8R1.7 NC(=O)C1=CSC=C1 Z82670330 [0,0,0,0,2,0|1,1,0]=4 1175 B8R1.7 NC(=S)C1=CC=CO1 Z235345623 [0,0,0,0,2,0|1,0,0]=3 1176 B8R1.7 NC(=S)C1=CC=CS1 Z56951809 [0,0,0,0,2,0|1,0,0]=3 1177 B8R1.7 NC(=S)C1=CSC=C1 Z99599750 [0,0,0,0,2,0|1,0,0]=3 1178 B12R1.252 CC(=O)NCCC1=CC=CC=C1 Z27761567 [0,0,0,0,0,2|1,1,0]=4 1179 B12R1.252 CC(=O)NNCC1=CC=CC=C1 Z1726022904 [0,0,0,0,0,2|1,1,0]=4 1180 B12R1.252 N=C(N)COCC1=CC=CC=C1 Z2574925846 [0,0,0,0,0,2|2,0,0]=4 1181 B12R1.252 N=C(N)CSCC1=CC=CC=C1 Z1795818268 [0,0,0,0,0,2|2,0,0]=4 1182 B12R1.252 N=C(N)N/N=C/C1=CC=CC=C1 Z56791605 [0,0,0,0,0,2|1,0,0]=3 1183 B12R1.252 N=C(N)NCCC1=NC=CC=C1 Z1089995406 [0,0,0,0,0,2|2,0,0]=4 1184 B12R1.252 NC(=O)CCNC1=CC=CC=C1 Z154666194 [0,0,0,0,0,2|0,1,0]=3 1185 B12R1.252 NC(=O)CCOC1=CC=CC=C1 Z33545291 [0,0,0,0,0,2|1,1,0]=4 1186 B12R1.252 NC(=O)CCSC1=CC=CC=C1 Z33547211 [0,0,0,0,0,2|1,1,0]=4 1187 B12R1.252 NC(=O)CNCC1=CC=CC=C1 Z90608463 [0,0,0,0,0,2|0,1,0]=3 1188 B12R1.252 NC(=O)CNCC1=CN=CC=C1 Z1695669950 [0,0,0,0,0,2|1,1,0]=4 1189 B12R1.252 NC(=O)COCC1=CC=CC=C1 Z52214418 [0,0,0,0,0,2|1,1,0]=4 1190 B12R1.252 NC(=O)N/N=C/C1=CN=CC=C1 Z49560577 [0,0,0,0,0,2|1,1,0]=4 1191 B12R1.252 NC(=O)NCCC1=CC=CC=C1 Z198194788 [0,0,0,0,0,2|0,1,0]=3 1192 B12R1.252 NC(=O)NCCC1=CN=CC=C1 Z432778234 [0,0,0,0,0,2|1,1,0]=4 1193 B12R1.252 NC(=O)NCCC1=NC=CC=C1 Z198194814 [0,0,0,0,0,2|1,1,0]=4 1194 B12R1.252 NC(=O)NOCC1=CC=CC=C1 Z56787772 [0,0,0,0,0,2|0,1,0]=3 1195 B12R1.252 NC(=S)N/N=C/C1=CC=CC=C1 Z49561493 [0,0,0,0,0,2|0,0,0]=2 1196 B12R1.252 NC(=S)N/N=C/C1=NC=CC=C1 Z49561480 [0,0,0,0,0,2|1,0,0]=3 1197 B12R1.252 NC(=S)NCCC1=CC=CC=C1 Z56933803 [0,0,0,0,0,2|0,0,0]=2 1198 B12R1.252 O=C(O)CCNC1=CC=CC=C1 Z56899128 [0,0,0,0,0,2|1,1,0]=4