0 B13R2.1 C#CCN1C=CC2=C1C=CC=C2 Z1069284234 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.1 C#CCN1C=NC2=C1C=CC=C2 Z54955567 [0,0,0,0,0,0|2,0,2]=4 2 B13R2.1 CCCN1C=NC2=C1C=CC=C2 Z53833307 [0,0,0,0,0,0|2,0,1]=3 3 B13R2.1 CNCC1=CSC2=C1C=CC=C2 Z415728090 [0,0,0,0,0,0|3,0,0]=3 4 B13R2.1 FCCN1N=NC2=C1C=CC=C2 Z2041722991 [0,0,0,0,0,0|3,0,1]=4 5 B13R2.1 N#CCC1=CNC2=C1C=CC=C2 Z104477894 [0,0,0,0,0,0|0,0,2]=2 6 B13R2.1 N#CCC1=CNC2=C1C=CC=N2 Z978942402 [0,0,0,0,0,0|1,0,2]=3 7 B13R2.1 N#CCC1=CNC2=C1C=CN=C2 Z1828214668 [0,0,0,0,0,0|1,0,2]=3 8 B13R2.1 N#CCC1=CNC2=C1N=CC=C2 Z1255440212 [0,0,0,0,0,0|1,0,2]=3 9 B13R2.1 N#CCC1=CSC2=C1C=CC=C2 Z431602866 [0,0,0,0,0,0|1,0,2]=3 10 B13R2.1 N#CCC1=NSC2=C1C=CC=C2 Z1198158705 [0,0,0,0,0,0|2,0,2]=4 11 B13R2.1 NCCC1=CNC2=C1C=CC=C2 Z104478080 [0,0,0,0,0,0|0,0,0]=0 12 B13R2.1 NCCC1=CNC2=C1C=CC=N2 Z3013846178 [0,0,0,0,0,0|1,0,0]=1 13 B13R2.1 NCCC1=CNC2=C1C=CN=C2 Z2685925193 [0,0,0,0,0,0|1,0,0]=1 14 B13R2.1 NCCC1=CNC2=C1N=CC=C2 Z1741982367 [0,0,0,0,0,0|1,0,0]=1 15 B13R2.1 NCCC1=CSC2=C1C=CC=C2 Z432090862 [0,0,0,0,0,0|1,0,0]=1 16 B13R2.1 NCCC1=NN=C2N1C=CC=C2 Z90660992 [0,0,0,0,0,0|2,0,1]=3 17 B13R2.1 NCCC1=NOC2=C1C=CC=C2 Z2492774449 [0,0,0,0,0,0|2,0,0]=2 18 B13R2.1 NCCN1C=NC2=C1C=CC=C2 Z607822458 [0,0,0,0,0,0|1,0,1]=2 19 B13R2.1 NCCN1C=NC2=C1N=CC=C2 Z4501471742 [0,0,0,0,0,0|2,0,1]=3 20 B13R2.1 NCCN1CCC2=C1C=CC=C2 Z594038402 [0,0,0,0,0,0|2,0,1]=3 21 B13R2.1 OCCC1=CNC2=C1C=CC=C2 Z1123806416 [0,0,0,0,0,0|1,0,0]=1 22 B13R2.1 OCCN1CCC2=C1C=CC=C2 Z425793930 [0,0,0,0,0,0|3,0,1]=4 23 B13R2.1 OCCN1N=CC2=C1C=CC=C2 Z959322444 [0,0,0,0,0,0|4,0,0]=4 24 B12R2.1 CCC1=CNC2=C1C=CC=C2 Z1198159100 [1,0,0,0,0,0|0,0,0]=1 25 B12R2.1 CCC1NCC2=C1C=CC=C2 Z2937794220 [1,0,0,0,0,0|2,0,1]=4 26 B12R2.1 CCN1C=NC2=C1C=CC=C2 Z53833304 [1,0,0,0,0,0|1,0,1]=3 27 B12R2.1 CNC1=NSC2=C1C=CC=C2 Z54745174 [1,0,0,0,0,0|3,0,0]=4 28 B12R2.1 CSC1=CNC2=C1C=CC=C2 Z1262562193 [1,0,0,0,0,0|1,0,0]=2 29 B12R2.1 ClCC1=CN=C2N1C=CC=C2 Z57033916 [1,0,0,0,0,0|2,0,1]=4 30 B12R2.1 N#CC1=CNC2=C1C=CC=C2 Z57204989 [1,0,0,0,0,0|0,0,2]=3 31 B12R2.1 N#CC1=COC2=C1C=CC=C2 Z1188275503 [1,0,0,0,0,0|1,0,2]=4 32 B12R2.1 N#CC1=NNC2=C1C=CC=C2 Z1198158918 [1,0,0,0,0,0|1,0,2]=4 33 B12R2.1 NCC1=C2C=CC=CN2C=N1 Z3241265506 [1,0,0,0,0,0|3,0,0]=4 34 B12R2.1 NCC1=C2C=CC=CN2N=C1 Z2065464373 [1,0,0,0,0,0|1,0,1]=3 35 B12R2.1 NCC1=CN=C2N1C=CC=C2 Z3234882063 [1,0,0,0,0,0|1,0,1]=3 36 B12R2.1 NCC1=CSC2=C1C=CC=C2 Z425459986 [1,0,0,0,0,0|1,0,0]=2 37 B12R2.1 NCC1=CSC2=C1N=CC=C2 Z1618144423 [1,0,0,0,0,0|2,0,0]=3 38 B12R2.1 NCC1=NC=C2N1C=CC=C2 Z2310702523 [1,0,0,0,0,0|3,0,0]=4 39 B12R2.1 NCC1=NN=C2N1C=CC=C2 Z57985996 [1,0,0,0,0,0|2,0,1]=4 40 B12R2.1 NCC1=NOC2=C1C=CC=C2 Z1203581810 [1,0,0,0,0,0|2,0,0]=3 41 B12R2.1 NCC1=NSC2=C1C=CC=C2 Z2456396538 [1,0,0,0,0,0|2,0,0]=3 42 B12R2.1 NCC1CCC2=C1C=CC=C2 Z415654944 [1,0,0,0,0,0|1,0,2]=4 43 B12R2.1 NCC1COC2=C1C=CC=C2 Z1197877490 [1,0,0,0,0,0|1,0,2]=4 44 B12R2.1 NCC1CSC2=C1C=CC=C2 Z1316760731 [1,0,0,0,0,0|1,0,2]=4 45 B12R2.1 NCC1OCC2=C1C=CC=C2 Z2310708138 [1,0,0,0,0,0|2,0,1]=4 46 B12R2.1 O=CC1=CNC2=C1C=CC=C2 Z56785575 [1,0,0,0,0,0|1,0,1]=3 47 B12R2.1 O=CC1=CNC2=C1C=CC=N2 Z57337365 [1,0,0,0,0,0|2,0,1]=4 48 B12R2.1 O=CC1=CNC2=C1C=CN=C2 Z1198176790 [1,0,0,0,0,0|2,0,1]=4 49 B12R2.1 O=CC1=CNC2=C1C=NC=C2 Z1079456084 [1,0,0,0,0,0|2,0,1]=4 50 B12R2.1 O=CC1=CNC2=C1N=CC=C2 Z1203747933 [1,0,0,0,0,0|2,0,1]=4 51 B12R2.1 O=CC1=COC2=C1C=CC=C2 Z1197879644 [1,0,0,0,0,0|2,0,1]=4 52 B12R2.1 O=CC1=CSC2=C1C=CC=C2 Z199535912 [1,0,0,0,0,0|2,0,1]=4 53 B12R2.1 O=CC1=NNC2=C1C=CC=C2 Z1065726010 [1,0,0,0,0,0|2,0,1]=4 54 B12R2.1 OCC1=CN=C2N1C=CC=C2 Z1198235297 [1,0,0,0,0,0|2,0,1]=4 55 B12R2.1 OCC1=CNC2=C1C=CC=C2 Z85923165 [1,0,0,0,0,0|1,0,0]=2 56 B12R2.1 OCC1=CNC2=C1C=CN=C2 Z2471603543 [1,0,0,0,0,0|2,0,0]=3 57 B12R2.1 OCC1=CSC2=C1C=CC=C2 Z385370244 [1,0,0,0,0,0|2,0,0]=3 58 B12R2.1 OCC1CNC2=C1C=CC=C2 Z2213893407 [1,0,0,0,0,0|1,0,2]=4 59 B12R2.1 OCN1C=NC2=C1C=CC=C2 Z56926682 [1,0,0,0,0,0|2,0,1]=4 60 B14R2.2 CC(=O)CC1=CNC2=C1C=CC=C2 Z277541166 [0,1,0,0,0,0|1,0,1]=3 61 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 Z199464144 [0,1,0,0,0,0|2,0,1]=4 62 B14R2.2 CC(C)CN1C=NC2=C1C=CC=C2 Z53833308 [0,1,0,0,0,0|2,0,1]=4 63 B14R2.2 CC(O)CN1C=NC2=C1C=CC=C2 Z600458200 [0,1,0,0,0,0|2,0,1]=4 64 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 Z56917380 [0,1,0,0,0,0|2,0,0]=3 65 B14R2.2 N=C(N)CN1C=NC2=C1C=CC=C2 Z1316651964 [0,1,0,0,0,0|1,0,2]=4 66 B14R2.2 NC(=O)CC1=CNC2=C1C=CC=C2 Z33546521 [0,1,0,0,0,0|0,0,1]=2 67 B14R2.2 NC(=O)CC1=NOC2=C1C=CC=C2 Z101186134 [0,1,0,0,0,0|2,0,1]=4 68 B14R2.2 NC(=O)CC1=NSC2=C1C=CC=C2 Z1198158706 [0,1,0,0,0,0|2,0,1]=4 69 B14R2.2 NC(=O)CN1C=NC2=C1C=CC=C2 Z19648288 [0,1,0,0,0,0|1,0,2]=4 70 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=C2 Z56913182 [0,1,0,0,0,0|1,0,1]=3 71 B14R2.2 O=C(O)CC1=CNC2=C1C=CC=N2 Z978942538 [0,1,0,0,0,0|2,0,1]=4 72 B14R2.2 O=C(O)CC1=CNC2=C1C=CN=C2 Z2213893334 [0,1,0,0,0,0|2,0,1]=4 73 B14R2.2 O=C(O)CC1=COC2=C1C=CC=C2 Z119989454 [0,1,0,0,0,0|2,0,1]=4 74 B14R2.2 O=C(O)CC1=CSC2=C1C=CC=C2 Z432090858 [0,1,0,0,0,0|2,0,1]=4 75 B14R2.2 O=C(O)CC1=NNC2=C1C=CC=C2 Z335442472 [0,1,0,0,0,0|2,0,1]=4 76 B14R2.3 CCNCC1=CNC2=C1C=CC=C2 Z1787158574 [0,1,0,0,0,0|1,0,0]=2 77 B14R2.3 COCCN1C=NC2=C1C=CC=C2 Z57187094 [0,1,0,0,0,0|2,0,1]=4 78 B14R2.3 N#CCCC1=NOC2=C1C=CC=C2 Z1504671781 [0,1,0,0,0,0|2,0,1]=4 79 B14R2.3 N#CCCN1C=CC2=C1C=CC=C2 Z56968850 [0,1,0,0,0,0|2,0,1]=4 80 B14R2.3 N#CCCN1C=NC2=C1C=CC=C2 Z53116462 [0,1,0,0,0,0|1,0,2]=4 81 B14R2.3 NCCCC1=CNC2=C1C=CC=C2 Z275361382 [0,1,0,0,0,0|0,0,0]=1 82 B14R2.3 NCCCC1=NN=C2N1C=CC=C2 Z1262250893 [0,1,0,0,0,0|2,0,1]=4 83 B14R2.3 NCCCN1C=CC2=C1C=CC=C2 Z57032590 [0,1,0,0,0,0|2,0,0]=3 84 B14R2.3 NCCCN1C=NC2=C1C=CC=C2 Z850542590 [0,1,0,0,0,0|1,0,1]=3 85 B14R2.3 NCCCN1CCC2=C1C=CC=C2 Z271005912 [0,1,0,0,0,0|2,0,1]=4 86 B14R2.7 CC1=C2CCN(C2=CC=C1)CCN Z4748438966 [0,1,0,0,0,0|2,0,1]=4 87 B14R2.7 CC1=C2NC=C(C2=CC=C1)CC#N Z1198165196 [0,1,0,0,0,0|0,0,2]=3 88 B14R2.7 CC1=C2NC=C(C2=CC=C1)CCN Z1203159755 [0,1,0,0,0,0|0,0,0]=1 89 B14R2.7 N#CCC1=CNC2=C(C=CC=C12)Br Z1269155333 [0,1,0,0,0,0|0,0,2]=3 90 B14R2.7 N#CCC1=CNC2=C(C=CC=C12)Cl Z1198263975 [0,1,0,0,0,0|0,0,2]=3 91 B14R2.7 N#CCC1=CNC2=C(C=CC=C12)F Z1198266461 [0,1,0,0,0,0|0,0,2]=3 92 B14R2.7 N#CCC1=CSC2=C(C=CC=C12)Br Z1436275301 [0,1,0,0,0,0|1,0,2]=4 93 B14R2.7 NCCC1=CNC2=C1C=CC=C2Br Z3241252952 [0,1,0,0,0,0|0,0,0]=1 94 B14R2.7 NCCC1=CNC2=C1C=CC=C2Cl Z2690204189 [0,1,0,0,0,0|0,0,0]=1 95 B14R2.7 NCCC1=CNC2=C1C=CC=C2F Z2940229235 [0,1,0,0,0,0|0,0,0]=1 96 B14R2.7 NCCN1CCC2=C(C=CC=C12)Br Z3333499909 [0,1,0,0,0,0|2,0,1]=4 97 B14R2.95 CC(CN)N1CCC2=C1C=CC=C2 Z270834258 [0,1,0,0,0,0|2,0,1]=4 98 B14R2.95 CCC(C)N1C=NC2=C1C=CC=C2 Z56919006 [0,1,0,0,0,0|2,0,1]=4 99 B14R2.95 CNC(=O)C1=CNC2=C1C=CC=C2 Z234895483 [0,1,0,0,0,0|2,0,1]=4 100 B14R2.95 COC(=O)C1=CNC2=C1C=CC=C2 Z57164966 [0,1,0,0,0,0|2,0,1]=4 101 B14R2.95 NCC(=O)C1=CNC2=C1C=CC=C2 Z3218021616 [0,1,0,0,0,0|0,0,1]=2 102 B14R2.95 NNC(=O)C1=CNC2=C1C=CC=C2 Z56955973 [0,1,0,0,0,0|1,0,1]=3 103 B14R2.95 O=C(CCl)C1=CNC2=C1C=CC=C2 Z56886524 [0,1,0,0,0,0|1,0,1]=3 104 B14R2.95 O=C(CCl)C1=CNC2=C1C=CC=N2 Z2378833037 [0,1,0,0,0,0|2,0,1]=4 105 B14R2.95 O=C(CCl)C1=CNC2=C1C=NC=C2 Z1783110847 [0,1,0,0,0,0|2,0,1]=4 106 B14R2.95 O=C(CCl)C1=CSC2=C1C=CC=C2 Z370714360 [0,1,0,0,0,0|2,0,1]=4 107 B14R2.95 O=C(NO)C1=CNC2=C1C=CC=C2 Z88293955 [0,1,0,0,0,0|2,0,1]=4 108 B14R2.467 CC1=CC2=C(C=C1)C(=CN2)CC#N Z410711548 [0,1,0,0,0,0|0,0,2]=3 109 B14R2.467 CC1=CC2=C(C=C1)C(=CN2)CCN Z410711590 [0,1,0,0,0,0|0,0,0]=1 110 B14R2.467 CCCC1=CNC2=C1C=CC(=C2)O Z1216831061 [0,1,0,0,0,0|1,0,0]=2 111 B14R2.467 CCCN1C=CC2=C1C=CC(=C2)N Z1262237261 [0,1,0,0,0,0|3,0,0]=4 112 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)Br Z978942444 [0,1,0,0,0,0|0,0,2]=3 113 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)Cl Z410711530 [0,1,0,0,0,0|0,0,2]=3 114 B14R2.467 N#CCC1=CNC2=C1C=CC(=C2)F Z410711556 [0,1,0,0,0,0|0,0,2]=3 115 B14R2.467 NC1=CC2=C(C=C1)N(C=C2)CCO Z385461612 [0,1,0,0,0,0|3,0,0]=4 116 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Br Z3235022918 [0,1,0,0,0,0|0,0,0]=1 117 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)Cl Z234895789 [0,1,0,0,0,0|0,0,0]=1 118 B14R2.467 NCCC1=CNC2=C1C=CC(=C2)F Z2724334834 [0,1,0,0,0,0|0,0,0]=1 119 B14R2.467 NCCC1=NOC2=C1C=CC(=C2)F Z3664675098 [0,1,0,0,0,0|2,0,0]=3 120 B14R2.467 NCCN1C=CC2=C1C=CC(=C2)Cl Z1162449834 [0,1,0,0,0,0|2,0,0]=3 121 B14R2.467 NCCN1C=NC2=C1C=CC(=C2)Cl Z3247494572 [0,1,0,0,0,0|1,0,1]=3 122 B14R2.467 NCCN1N=CC2=C1C=CC(=C2)Br Z5981159774 [0,1,0,0,0,0|3,0,0]=4 123 B14R2.467 OCCN1C=CC2=C1C=CC(=C2)Cl Z1721722998 [0,1,0,0,0,0|3,0,0]=4 124 B14R2.510 CN1C=C(C2=C1C=CC=C2)CC#N Z1198184446 [0,1,0,0,0,0|0,0,2]=3 125 B14R2.510 CN1C=C(C2=C1C=CC=C2)CCN Z2492749416 [0,1,0,0,0,0|0,0,0]=1 126 B14R2.510 CN1N=C(C2=C1C=CC=C2)CCN Z1268480764 [0,1,0,0,0,0|1,0,0]=2 127 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CC#N Z57921853 [0,1,0,0,0,0|0,0,2]=3 128 B14R2.517 CC1=C(C2=C(N1)C=CC=C2)CCN Z336079656 [0,1,0,0,0,0|0,0,0]=1 129 B14R2.517 CC1=CC2=C(N1CCN)C=CC=N2 Z4513831052 [0,1,0,0,0,0|3,0,0]=4 130 B14R2.517 CC1=NC2=C(N1CCN)C=CC=C2 Z94602045 [0,1,0,0,0,0|1,0,1]=3 131 B14R2.517 CC1=NC2=C(N1CCO)C=CC=C2 Z56989568 [0,1,0,0,0,0|2,0,1]=4 132 B14R2.517 CCCN1C(=NC2=C1C=CC=C2)N Z56862261 [0,1,0,0,0,0|2,0,1]=4 133 B14R2.517 CCCN1C(=NC2=C1C=CC=C2)S Z56821176 [0,1,0,0,0,0|2,0,1]=4 134 B14R2.517 CCCN1C(=O)NC2=C1C=CC=C2 Z56791853 [0,1,0,0,0,0|2,0,0]=3 135 B14R2.517 CNCC1=C(OC2=C1C=CC=C2)C Z3014621565 [0,1,0,0,0,0|3,0,0]=4 136 B14R2.517 N#C/C=C\1/C(=O)NC2=C1C=CC=C2 Z1170430293 [0,1,0,0,0,0|0,0,3]=4 137 B14R2.517 N#CCC1C(=O)NC2=C1C=CC=C2 Z166652078 [0,1,0,0,0,0|0,0,3]=4 138 B14R2.517 NCCC1C(=O)NC2=C1C=CC=C2 Z235344885 [0,1,0,0,0,0|0,0,1]=2 139 B14R2.517 NCCN1C(=O)CC2=C1C=CC=C2 Z4447090207 [0,1,0,0,0,0|2,0,0]=3 140 B14R2.517 NCCN1C(=O)NC2=C1C=CC=C2 Z1354416053 [0,1,0,0,0,0|1,0,0]=2 141 B14R2.517 NCCN1C(=O)OC2=C1C=CC=C2 Z234897259 [0,1,0,0,0,0|2,0,0]=3 142 B14R2.517 O=C1OC2=C(N1CCBr)C=CC=C2 Z285922104 [0,1,0,0,0,0|3,0,0]=4 143 B14R2.517 O=C1OC2=C(N1CCO)C=CC=C2 Z425794534 [0,1,0,0,0,0|3,0,0]=4 144 B14R2.517 O=C1SC2=C(N1CCF)C=CC=C2 Z1449371798 [0,1,0,0,0,0|3,0,0]=4 145 B14R2.6368 CC1=C2C(=CNC2=CC=C1)CC#N Z410711540 [0,1,0,0,0,0|0,0,2]=3 146 B14R2.6368 CC1=C2C(=CNC2=CC=C1)CCN Z234896787 [0,1,0,0,0,0|0,0,0]=1 147 B14R2.6368 CC1=C2C(=CNC2=NC=C1)CCN Z2752645312 [0,1,0,0,0,0|1,0,0]=2 148 B14R2.6368 N#CCC1=CNC2=CC=CC(=C12)Br Z1269165311 [0,1,0,0,0,0|0,0,2]=3 149 B14R2.6368 N#CCC1=CNC2=CC=CC(=C12)Cl Z1198155856 [0,1,0,0,0,0|0,0,2]=3 150 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)Br Z2130641487 [0,1,0,0,0,0|0,0,0]=1 151 B14R2.6368 NCCC1=CNC2=C1C(=CC=C2)F Z3301406433 [0,1,0,0,0,0|0,0,0]=1 152 B14R2.6419 CC1=CC2=C(C=C1)NC=C2CCN Z2106599153 [0,1,0,0,0,0|0,0,0]=1 153 B14R2.6419 CC1=NC2=C(C=C1)NC=C2CCN Z2798529206 [0,1,0,0,0,0|1,0,0]=2 154 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)Br Z410711512 [0,1,0,0,0,0|0,0,2]=3 155 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)Cl Z1162450204 [0,1,0,0,0,0|0,0,2]=3 156 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)F Z1160903139 [0,1,0,0,0,0|0,0,2]=3 157 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)N Z1255366408 [0,1,0,0,0,0|0,0,2]=3 158 B14R2.6419 N#CCC1=CNC2=C1C=C(C=C2)O Z1198149461 [0,1,0,0,0,0|0,0,2]=3 159 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Br Z2760930339 [0,1,0,0,0,0|0,0,0]=1 160 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)Cl Z1266933935 [0,1,0,0,0,0|0,0,0]=1 161 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)F Z1741960310 [0,1,0,0,0,0|0,0,0]=1 162 B14R2.6419 NCCC1=CNC2=C1C=C(C=C2)O Z1741979085 [0,1,0,0,0,0|0,0,0]=1 163 B14R2.6419 NCCC1=CNC2=C1C=C(C=N2)F Z3386766102 [0,1,0,0,0,0|1,0,0]=2 164 B14R2.6419 NCCC1=CSC2=C1C=C(C=C2)Br Z1269157473 [0,1,0,0,0,0|1,0,0]=2 165 B14R2.9718 NCCC1(CCC2=C1C=CC=C2)O Z3759405241 [0,1,0,0,0,0|1,0,2]=4 166 B12R1.3 CCCC(C=O)C1=CC=CC=C1 Z1251357295 [0,0,1,0,0,0|2,0,1]=4 167 B12R1.3 NCC(CCO)C1=CC=CC=C1 Z1198177199 [0,0,1,0,0,0|1,0,2]=4 168 B12R1.8 NCCCCCC1=CC=CC=C1 Z820118542 [0,0,1,0,0,0|1,0,2]=4 169 B12R1.8 NCCCCNC1=NC=CC=C1 Z600500000 [0,0,1,0,0,0|1,0,2]=4 170 B12R1.8 NCCCOCC1=CC=CC=C1 Z104377938 [0,0,1,0,0,0|2,0,1]=4 171 B12R1.8 NCCOCCC1=CC=CC=C1 Z1270210787 [0,0,1,0,0,0|2,0,1]=4 172 B12R1.121 COC1=C(C=CC=C1)OCCN Z56968779 [0,0,1,0,0,0|2,0,1]=4 173 B12R1.308 CCCC(=O)C1=C(C=CC=C1)Cl Z733415242 [0,0,1,0,0,0|3,0,0]=4 174 B12R1.308 CCCN(C)C1=C(C=CC=C1)N Z409202040 [0,0,1,0,0,0|2,0,1]=4 175 B12R1.308 CCNC(=O)C1=C(C=CC=C1)N Z99599872 [0,0,1,0,0,0|3,0,0]=4 176 B12R1.308 NCCC(=O)C1=C(C=CC=C1)N Z2037273395 [0,0,1,0,0,0|1,0,0]=2 177 B12R1.308 NCCS(=O)C1=C(C=CC=C1)F Z1267881675 [0,0,1,0,0,0|3,0,0]=4 178 B14R3.7 NC1CC12CCC3=C2C=CC=C3 Z1496496361 [0,0,0,1,0,0|1,0,2]=4 179 B14R3.49 C1=CC2=C(C=C1)C3=C(N2)CCC3 Z57479476 [0,0,0,1,0,0|1,0,0]=2 180 B14R3.49 C1=CC2=C(C=C1)N3CCCC3=N2 Z1198156372 [0,0,0,1,0,0|2,0,1]=4 181 B14R3.49 C1=CC2=C(C=C1)N3CCNC3=N2 Z56854350 [0,0,0,1,0,0|1,0,1]=3 182 B14R3.3059 C1=CC2=C(C=C1)C3(CCC3)CN2 Z1836338847 [0,0,0,1,0,0|1,0,2]=4 183 B14R3.17744 NCC1C2C1C3=C(C2)C=CC=C3 Z1436410963 [0,0,0,1,0,0|1,0,2]=4 184 B14R2.112 CCNC1=CC2=C(C=CC=C2)C=C1 Z286374752 [0,0,0,0,0,1|3,0,0]=4 185 B14R2.112 CCOC1=CC2=C(C=CC=C2)C=C1 Z53835291 [0,0,0,0,0,1|3,0,0]=4 186 B14R2.112 CNCC1=NC2=C(C=CC=C2)C=C1 Z5065258661 [0,0,0,0,0,1|3,0,0]=4 187 B14R2.112 N#CCC1=CC2=C(C=CC=C2)N=C1 Z1198162168 [0,0,0,0,0,1|0,0,3]=4 188 B14R2.112 N#CCC1=NC2=C(C=CC=C2)N=C1 Z1098233908 [0,0,0,0,0,1|0,0,3]=4 189 B14R2.112 N/N=C/C1=NC2=C(C=CC=C2)N=C1 Z2583440170 [0,0,0,0,0,1|1,0,2]=4 190 B14R2.112 NCCC1=CC2=C(C=CC=C2)C=C1 Z381785718 [0,0,0,0,0,1|1,0,0]=2 191 B14R2.112 NCCC1CCC2=C(C1)C=CC=C2 Z3444473353 [0,0,0,0,0,1|1,0,2]=4 192 B14R2.112 NCCC1COC2=C(O1)C=CC=C2 Z1198157388 [0,0,0,0,0,1|1,0,2]=4 193 B14R2.112 NCCC1CSC2=C(O1)C=CC=C2 Z2379807813 [0,0,0,0,0,1|1,0,2]=4 194 B14R2.112 OCCC1=CC2=C(C=CC=C2)C=C1 Z397587214 [0,0,0,0,0,1|2,0,0]=3 195 B14R2.112 OCCC1=CC2=C(C=CC=N2)C=C1 Z1198313086 [0,0,0,0,0,1|3,0,0]=4 196 B14R2.112 OCCC1=NC2=C(C=CC=C2)C=C1 Z1198157695 [0,0,0,0,0,1|2,0,0]=3 197 B14R2.7150 CCOC1=C2C=CC=CC2=CC=C1 Z55021536 [0,0,0,0,0,1|3,0,0]=4 198 B14R2.7150 CCSC1=C2C=CC=CC2=NC=N1 Z19315993 [0,0,0,0,0,1|2,0,1]=4 199 B14R2.7150 CNCC1=C2C=CC=CC2=CC=C1 Z445129424 [0,0,0,0,0,1|3,0,0]=4 200 B14R2.7150 N#CCC1=C2C=CC=CC2=CC=C1 Z285184572 [0,0,0,0,0,1|1,0,2]=4 201 B14R2.7150 N#CCC1=C2C=CC=CC2=CC=N1 Z1255462481 [0,0,0,0,0,1|1,0,2]=4 202 B14R2.7150 NCCC1=C2C=CC=CC2=CC=C1 Z285143746 [0,0,0,0,0,1|1,0,0]=2 203 B14R2.7150 NCCC1=C2C=CC=NC2=CC=C1 Z3241223114 [0,0,0,0,0,1|2,0,0]=3 204 B14R2.7150 NCCN1CCCC2=C1C=CC=C2 Z1217910572 [0,0,0,0,0,1|2,0,1]=4 205 B14R2.7150 NNCC1=C2C=CC=CC2=CC=C1 Z406679924 [0,0,0,0,0,1|2,0,0]=3 206 B14R2.7150 O=CCC1=C2C=CC=CC2=CC=C1 Z1020779918 [0,0,0,0,0,1|2,0,1]=4 207 B14R2.7150 OCCC1=C2C=CC=CC2=NC=C1 Z1198313078 [0,0,0,0,0,1|1,0,1]=3 208 B11R1.12 CCC(C=O)C1=CC=CC=C1 Z1079132778 [1,0,1,0,0,0|1,0,1]=4 209 B11R1.12 CCC(CN)C1=CC=CC=C1 Z85956799 [1,0,1,0,0,0|0,0,2]=4 210 B11R1.16 CCCC(=O)C1=CC=CC=C1 Z104477742 [1,0,1,0,0,0|2,0,0]=4 211 B11R1.16 CN(CCN)C1=CC=CC=C1 Z154669318 [1,0,1,0,0,0|1,0,1]=4 212 B11R1.16 NC(CCO)C1=CC=CC=C1 Z382816560 [1,0,1,0,0,0|1,0,1]=4 213 B11R1.16 NCCC(O)C1=CC=CC=C1 Z1020673398 [1,0,1,0,0,0|1,0,1]=4 214 B11R1.16 NCCS(=O)C1=CC=CC=C1 Z1266854955 [1,0,1,0,0,0|2,0,0]=4 215 B11R1.16 O=C(CCCl)C1=CC=CC=C1 Z1065610596 [1,0,1,0,0,0|2,0,0]=4 216 B11R1.28 NCCCCC1=CC=CC=C1 Z2574929438 [1,0,1,0,0,0|0,0,2]=4 217 B11R1.28 NCCCNC1=CC=CC=C1 Z756919512 [1,0,1,0,0,0|0,0,1]=3 218 B11R1.28 NCCCNC1=CC=NC=C1 Z317257864 [1,0,1,0,0,0|1,0,1]=4 219 B11R1.28 NCCCNC1=NC=CC=C1 Z234895141 [1,0,1,0,0,0|1,0,1]=4 220 B11R1.28 NCCCOC1=CC=CC=C1 Z234895129 [1,0,1,0,0,0|1,0,1]=4 221 B11R1.28 NCCCSC1=CC=CC=C1 Z262222134 [1,0,1,0,0,0|1,0,1]=4 222 B11R1.28 NCCOCC1=CC=CC=C1 Z271005946 [1,0,1,0,0,0|1,0,1]=4 223 B11R1.28 OCCCNC1=CC=CC=C1 Z104584292 [1,0,1,0,0,0|1,0,1]=4 224 B11R1.17 CC1=C(C=CC=C1)CCCN Z424782962 [1,0,1,0,0,0|0,0,2]=4 225 B11R1.17 CC1=C(C=CC=C1)OCCN Z223656356 [1,0,1,0,0,0|1,0,1]=4 226 B11R1.17 CCCNC1=C(C=CC=C1)N Z94601320 [1,0,1,0,0,0|2,0,0]=4 227 B11R1.17 CCCOC1=C(C=CC=C1)N Z56968930 [1,0,1,0,0,0|2,0,0]=4 228 B11R1.17 NC1=C(C=CC=C1)CCCO Z1198265858 [1,0,1,0,0,0|1,0,1]=4 229 B11R1.17 NC1=C(C=CC=C1)NCCO Z55928991 [1,0,1,0,0,0|2,0,0]=4 230 B11R1.17 NC1=C(C=CC=C1)OCCO Z3445703033 [1,0,1,0,0,0|2,0,0]=4 231 B11R1.17 NCCCC1=C(C=CC=C1)Cl Z1695729033 [1,0,1,0,0,0|1,0,1]=4 232 B11R1.17 NCCCC1=C(C=CC=C1)F Z424783030 [1,0,1,0,0,0|1,0,1]=4 233 B11R1.17 NCCNC1=C(C=CC=C1)N Z991530054 [1,0,1,0,0,0|1,0,0]=3 234 B11R1.17 NCCOC1=C(C=CC=C1)Br Z803145324 [1,0,1,0,0,0|2,0,0]=4 235 B11R1.17 NCCOC1=C(C=CC=C1)Cl Z54747867 [1,0,1,0,0,0|2,0,0]=4 236 B11R1.17 NCCOC1=C(C=CC=C1)F Z1272739857 [1,0,1,0,0,0|2,0,0]=4 237 B11R1.17 NCCOC1=C(C=CC=C1)O Z3217405430 [1,0,1,0,0,0|2,0,0]=4 238 B11R1.17 NCCSC1=C(C=CC=C1)F Z57971449 [1,0,1,0,0,0|2,0,0]=4 239 B11R1.41 CCOC1=C(C=CC=C1)NC Z1526503386 [1,0,1,0,0,0|1,0,1]=4 240 B11R1.41 COC1=C(C=CC=C1)CCN Z104493472 [1,0,1,0,0,0|1,0,1]=4 241 B11R1.41 N#CC1=C(C=CC=C1)CCN Z1198235631 [1,0,1,0,0,0|2,0,0]=4 242 B11R1.222 CC1=C(C=CC=C1)C(=O)CN Z1741966378 [1,0,1,0,0,0|2,0,0]=4 243 B11R1.222 CCC(=O)C1=C(C=CC=C1)Br Z851790216 [1,0,1,0,0,0|2,0,0]=4 244 B11R1.222 CCC(=O)C1=C(C=CC=C1)N Z1201617664 [1,0,1,0,0,0|1,0,0]=3 245 B11R1.222 CCN(C)C1=C(C=CC=C1)N Z409023630 [1,0,1,0,0,0|1,0,1]=4 246 B11R1.222 CCS(=O)C1=C(C=CC=C1)N Z808592520 [1,0,1,0,0,0|2,0,0]=4 247 B11R1.222 CNC(=O)C1=C(C=CC=C1)N Z57124070 [1,0,1,0,0,0|2,0,0]=4 248 B11R1.222 NCC(=O)C1=C(C=CC=C1)Br Z1262691661 [1,0,1,0,0,0|2,0,0]=4 249 B11R1.222 NCC(=O)C1=C(C=CC=C1)Cl Z1695906936 [1,0,1,0,0,0|2,0,0]=4 250 B11R1.222 NCC(=O)C1=C(C=CC=C1)F Z1741977084 [1,0,1,0,0,0|2,0,0]=4 251 B11R1.222 NNC(=O)C1=C(C=CC=C1)N Z104472510 [1,0,1,0,0,0|2,0,0]=4 252 B11R2.1 BrC1=CNC2=C1C=CC=N2 Z1665033561 [2,0,0,0,0,0|2,0,0]=4 253 B11R2.1 BrC1=CNC2=C1C=CN=C2 Z3302856393 [2,0,0,0,0,0|2,0,0]=4 254 B11R2.1 BrC1=NNC2=C1C=CC=C2 Z56791616 [2,0,0,0,0,0|2,0,0]=4 255 B11R2.1 CC1=C2C=CC=CC2=NN1 Z1258992514 [2,0,0,0,0,0|1,0,1]=4 256 B11R2.1 CC1=CNC2=C1C=CC=C2 Z415653134 [2,0,0,0,0,0|0,0,0]=2 257 B11R2.1 CC1=CNC2=C1N=CC=C2 Z1203733882 [2,0,0,0,0,0|1,0,0]=3 258 B11R2.1 CC1=COC2=C1C=CC=C2 Z1203161674 [2,0,0,0,0,0|1,0,0]=3 259 B11R2.1 CC1=NNC2=C1C=CC=N2 Z1198220784 [2,0,0,0,0,0|2,0,0]=4 260 B11R2.1 CC1=NNC2=C1C=NC=C2 Z1198341461 [2,0,0,0,0,0|2,0,0]=4 261 B11R2.1 CC1=NOC2=C1C=CC=C2 Z104341886 [2,0,0,0,0,0|2,0,0]=4 262 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [2,0,0,0,0,0|0,0,2]=4 263 B11R2.1 CN1C=NC2=C1C=CC=C2 Z53833303 [2,0,0,0,0,0|1,0,1]=4 264 B11R2.1 C[N+]1=CSC2=C1C=CC=C2 Z56791134 [2,0,0,0,0,0|2,0,0]=4 265 B11R2.1 ClC1=CNC2=C1C=CC=C2 Z1020823312 [2,0,0,0,0,0|1,0,0]=3 266 B11R2.1 ClC1=CNC2=C1C=CN=C2 Z1618035710 [2,0,0,0,0,0|2,0,0]=4 267 B11R2.1 IC1=CNC2=C1C=CC=N2 Z1269158296 [2,0,0,0,0,0|2,0,0]=4 268 B11R2.1 IC1=CNC2=C1C=CN=C2 Z1269236830 [2,0,0,0,0,0|2,0,0]=4 269 B11R2.1 IC1=CNC2=C1C=NC=C2 Z1154254658 [2,0,0,0,0,0|2,0,0]=4 270 B11R2.1 IC1=CNC2=C1N=CC=C2 Z1269234225 [2,0,0,0,0,0|2,0,0]=4 271 B11R2.1 NC1=C2C=CC=CC2=NS1 Z1198161072 [2,0,0,0,0,0|1,0,1]=4 272 B11R2.1 NC1=CN=C2N1C=CC=C2 Z1203578955 [2,0,0,0,0,0|1,0,1]=4 273 B11R2.1 NC1=NNC2=C1C=CC=C2 Z56820416 [2,0,0,0,0,0|1,0,0]=3 274 B11R2.1 NC1=NNC2=C1C=CN=C2 Z1203582635 [2,0,0,0,0,0|2,0,0]=4 275 B11R2.1 NC1=NNC2=C1N=CC=C2 Z1203639500 [2,0,0,0,0,0|2,0,0]=4 276 B11R2.1 NC1=NOC2=C1C=CC=C2 Z218760918 [2,0,0,0,0,0|2,0,0]=4 277 B11R2.1 NC1=NSC2=C1C=CC=C2 Z56774438 [2,0,0,0,0,0|2,0,0]=4 278 B11R2.1 NN1C=NC2=C1C=CC=C2 Z99599676 [2,0,0,0,0,0|1,0,1]=4 279 B11R2.1 O=C1NNC2=C1C=CC=C2 Z586248764 [2,0,0,0,0,0|2,0,0]=4 280 B11R2.1 O=C1SNC2=C1C=CC=C2 Z992282928 [2,0,0,0,0,0|2,0,0]=4 281 B13R1.26 NCCC/C(=N/O)/C1=CC=CC=C1 Z235348081 [0,1,1,0,0,0|2,0,0]=4 282 B13R1.405 CCCC(C(=O)N)C1=CC=CC=C1 Z33547037 [0,1,1,0,0,0|1,0,1]=4 283 B13R1.24 CN(CCCCN)C1=CC=CC=C1 Z285162604 [0,1,1,0,0,0|0,0,2]=4 284 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 Z285214492 [0,1,1,0,0,0|2,0,0]=4 285 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 Z1436181402 [0,1,1,0,0,0|2,0,0]=4 286 B13R1.44 CCCNC(=O)NC1=CC=CC=C1 Z44586337 [0,1,1,0,0,0|2,0,0]=4 287 B13R1.44 NCCCC(=O)NC1=CC=CC=C1 Z1449746694 [0,1,1,0,0,0|0,0,1]=3 288 B13R1.44 NCCNC(=O)CC1=CC=CC=C1 Z285226374 [0,1,1,0,0,0|2,0,0]=4 289 B13R1.44 NCCNC(=S)NC1=CC=CC=C1 Z56814594 [0,1,1,0,0,0|1,0,0]=3 290 B13R1.446 NCCC(=O)C1=C(C=CC(=C1)O)N Z5003485462 [0,1,1,0,0,0|1,0,0]=3 291 B13R1.674 CCCNC(=O)C1=C(C=CC=C1)N Z56347081 [0,1,1,0,0,0|2,0,0]=4 292 B13R1.674 NC1=C(C=CC=C1)C(=O)NCCO Z390185000 [0,1,1,0,0,0|2,0,0]=4 293 B13R1.674 NCCNC(=O)C1=C(C=CC=C1)Cl Z1250132251 [0,1,1,0,0,0|2,0,0]=4 294 B13R1.674 NCCNC(=O)C1=C(C=CC=C1)F Z259720724 [0,1,1,0,0,0|2,0,0]=4 295 B13R2.9 CC1=C2NC=C(C2=CC=C1)C=O Z1255486095 [1,1,0,0,0,0|1,0,1]=4 296 B13R2.9 CCN1C=NC2=C1C=CC=C2Br Z3300741815 [1,1,0,0,0,0|1,0,1]=4 297 B13R2.9 N#CC1=CNC2=C(C=CC=C12)Cl Z1198224612 [1,1,0,0,0,0|0,0,2]=4 298 B13R2.9 NCC1=CSC2=C1C=CC=C2Br Z4950571740 [1,1,0,0,0,0|1,0,0]=3 299 B13R2.9 NCC1=CSC2=C1C=CC=C2Cl Z4935700822 [1,1,0,0,0,0|1,0,0]=3 300 B13R2.9 NCC1=CSC2=C1C=CC=C2F Z4987427839 [1,1,0,0,0,0|1,0,0]=3 301 B13R2.9 O=CC1=CNC2=C(C=CC=C12)Br Z1269215784 [1,1,0,0,0,0|1,0,1]=4 302 B13R2.9 O=CC1=CNC2=C(C=CC=C12)Cl Z1201623572 [1,1,0,0,0,0|1,0,1]=4 303 B13R2.9 O=CC1=CNC2=C(C=CC=C12)F Z1198161592 [1,1,0,0,0,0|1,0,1]=4 304 B13R2.9 OCC1=CNC2=C1C=CC=C2Br Z1269128965 [1,1,0,0,0,0|1,0,0]=3 305 B13R2.72 CC(=O)C1=CNC2=C1C=CC=N2 Z361892222 [1,1,0,0,0,0|1,0,1]=4 306 B13R2.72 CC(=O)C1=COC2=C1C=CC=C2 Z1066258200 [1,1,0,0,0,0|1,0,1]=4 307 B13R2.72 CC(=O)C1=CSC2=C1C=CC=C2 Z370714364 [1,1,0,0,0,0|1,0,1]=4 308 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 Z1198176576 [1,1,0,0,0,0|1,0,1]=4 309 B13R2.72 CC(C)C1=CNC2=C1C=CC=C2 Z1262562313 [1,1,0,0,0,0|0,0,0]=2 310 B13R2.72 CC(N)C1=CSC2=C1C=CC=C2 Z370714584 [1,1,0,0,0,0|1,0,0]=3 311 B13R2.72 CC(O)C1=NNC2=C1C=CC=C2 Z1617999565 [1,1,0,0,0,0|1,0,0]=3 312 B13R2.72 N=C(N)C1=CNC2=C1C=CC=C2 Z3300708685 [1,1,0,0,0,0|0,0,1]=3 313 B13R2.72 NC(=O)C1=CNC2=C1C=CC=C2 Z87615024 [1,1,0,0,0,0|0,0,1]=3 314 B13R2.72 O=C(O)C1=CNC2=C1C=CC=C2 Z89283908 [1,1,0,0,0,0|1,0,1]=4 315 B13R2.135 CC1=C(C2=C(N1)C=CC=C2)C=O Z57197606 [1,1,0,0,0,0|1,0,1]=4 316 B13R2.135 CC1=C(C2=C(O1)C=CC=C2)CO Z1198320599 [1,1,0,0,0,0|2,0,0]=4 317 B13R2.135 CC1=C(C2=C(S1)C=CC=C2)CN Z3357888122 [1,1,0,0,0,0|1,0,0]=3 318 B13R2.135 CCC1C(=O)NC2=C1C=CC=C2 Z1201625783 [1,1,0,0,0,0|0,0,1]=3 319 B13R2.135 CCN1C(=NC2=C1C=CC=C2)N Z56921771 [1,1,0,0,0,0|1,0,1]=4 320 B13R2.135 CCN1C(=NC2=C1C=CC=C2)S Z56896246 [1,1,0,0,0,0|1,0,1]=4 321 B13R2.135 CCN1C(=O)NC2=C1C=CC=C2 Z57114989 [1,1,0,0,0,0|1,0,0]=3 322 B13R2.135 CC[N+]1=C(SC2=C1C=CC=C2)C Z56764369 [1,1,0,0,0,0|2,0,0]=4 323 B13R2.135 N#CC1=C(NC2=C1C=CC=C2)N Z317054182 [1,1,0,0,0,0|0,0,2]=4 324 B13R2.135 N#CC1=C(NC2=C1C=CC=C2)O Z440730498 [1,1,0,0,0,0|0,0,2]=4 325 B13R2.135 N/N=C\1/C(=O)NC2=C1C=CC=C2 Z56788834 [1,1,0,0,0,0|1,0,0]=3 326 B13R2.135 NCC1=C(SC2=C1C=CC=C2)Br Z4601667795 [1,1,0,0,0,0|1,0,0]=3 327 B13R2.135 O=CC1=C(NC2=C1C=CC=C2)Cl Z89264872 [1,1,0,0,0,0|1,0,1]=4 328 B13R2.135 O=C\1NC2=C(/C1=N\O)C=CC=C2 Z49568307 [1,1,0,0,0,0|2,0,0]=4 329 B13R2.662 CC1=CC2=C(C=C1)C(=CN2)C=O Z385446066 [1,1,0,0,0,0|1,0,1]=4 330 B13R2.662 CCN1C=CC2=C1C=CC(=C2)N Z910842434 [1,1,0,0,0,0|2,0,0]=4 331 B13R2.662 NCC1=CSC2=C1C=CC(=C2)Br Z5090452324 [1,1,0,0,0,0|1,0,0]=3 332 B13R2.662 NCC1=CSC2=C1C=CC(=C2)Cl Z5160957276 [1,1,0,0,0,0|1,0,0]=3 333 B13R2.662 O=CC1=CNC2=C1C=CC(=C2)Br Z916010012 [1,1,0,0,0,0|1,0,1]=4 334 B13R2.662 O=CC1=CNC2=C1C=CC(=C2)Cl Z385446068 [1,1,0,0,0,0|1,0,1]=4 335 B13R2.662 O=CC1=CNC2=C1C=CC(=C2)F Z385446070 [1,1,0,0,0,0|1,0,1]=4 336 B13R2.2091 CC1=C2C(=CNC2=CC=C1)C=O Z385446064 [1,1,0,0,0,0|1,0,1]=4 337 B13R2.2091 CC1=C2C(=CNC2=CC=C1)CO Z234893961 [1,1,0,0,0,0|1,0,0]=3 338 B13R2.2091 CCC1=CNC2=C1C(=CC=N2)Cl Z2895174379 [1,1,0,0,0,0|1,0,0]=3 339 B13R2.2091 CCC1=CNC2=C1C(=NC=N2)Cl Z1255453476 [1,1,0,0,0,0|2,0,0]=4 340 B13R2.2091 NCC1=CSC2=C1C(=CC=C2)Cl Z5042957143 [1,1,0,0,0,0|1,0,0]=3 341 B13R2.2091 NCC1=CSC2=C1C(=CC=C2)F Z5033029666 [1,1,0,0,0,0|1,0,0]=3 342 B13R2.2091 O=CC1=CNC2=CC=CC(=C12)Br Z1269207040 [1,1,0,0,0,0|1,0,1]=4 343 B13R2.2091 O=CC1=CNC2=CC=CC(=C12)Cl Z1201623227 [1,1,0,0,0,0|1,0,1]=4 344 B13R2.2091 O=CC1=CNC2=CC=CC(=C12)F Z1198149464 [1,1,0,0,0,0|1,0,1]=4 345 B13R2.2091 OCC1=CNC2=C1C(=CC=C2)Br Z1269170056 [1,1,0,0,0,0|1,0,0]=3 346 B13R2.2136 CC1=CC2=C(C=C1)NC=C2C=O Z1138836779 [1,1,0,0,0,0|1,0,1]=4 347 B13R2.2136 CCN1C=NC2=C1C=C(C=C2)C Z1216845367 [1,1,0,0,0,0|1,0,1]=4 348 B13R2.2136 NCC1=CSC2=C1C=C(C=C2)Br Z1269189897 [1,1,0,0,0,0|1,0,0]=3 349 B13R2.2136 NCC1=CSC2=C1C=C(C=C2)Cl Z3241270076 [1,1,0,0,0,0|1,0,0]=3 350 B13R2.2136 NCC1=CSC2=C1C=C(C=C2)F Z4644231534 [1,1,0,0,0,0|1,0,0]=3 351 B13R2.2136 NCC1=NNC2=C1C=C(C=C2)Cl Z3485797794 [1,1,0,0,0,0|1,0,0]=3 352 B13R2.2136 NCC1=NOC2=C1C=C(C=C2)F Z2738925069 [1,1,0,0,0,0|2,0,0]=4 353 B13R2.2136 O=CC1=CNC2=C1C=C(C=C2)Br Z57627647 [1,1,0,0,0,0|1,0,1]=4 354 B13R2.2136 O=CC1=CNC2=C1C=C(C=C2)F Z932263796 [1,1,0,0,0,0|1,0,1]=4 355 B13R2.2931 CN1C=C(C2=C1C=CC=C2)C=O Z56785556 [1,1,0,0,0,0|1,0,1]=4 356 B13R2.2931 CN1C=C(C2=C1C=CC=C2)CN Z3235193637 [1,1,0,0,0,0|0,0,0]=2 357 B13R2.2931 CNC1=CN(C2=C1C=CC=C2)C Z3446209986 [1,1,0,0,0,0|1,0,0]=3 358 B13R2.259 CC1=CC2=C(S1)SC=C2CCN Z2935022227 [0,1,0,0,1,0|2,0,0]=4 359 B15R2.352 BrCCOC1=CC2=C(C=CC=C2)C=C1 Z285922232 [0,1,0,0,0,1|2,0,0]=4 360 B15R2.352 CCNCC1=CC2=C(C=CC=C2)C=C1 Z90513510 [0,1,0,0,0,1|2,0,0]=4 361 B15R2.352 CCNCC1=NC2=C(C=CC=C2)C=C1 Z1266854958 [0,1,0,0,0,1|2,0,0]=4 362 B15R2.352 NCCNC1=NC2=C(C=CC=C2)C=C1 Z802671684 [0,1,0,0,0,1|1,0,0]=3 363 B15R2.352 NCCOC1=CC2=C(C=CC=C2)C=C1 Z335451476 [0,1,0,0,0,1|1,0,0]=3 364 B15R2.352 O=CCCC1=CC2=C(C=CC=C2)N=C1 Z1233208003 [0,1,0,0,0,1|1,0,1]=4 365 B15R2.352 OCCCC1=NC2=C(C=CC=C2)C=C1 Z1198265860 [0,1,0,0,0,1|2,0,0]=4 366 B15R2.352 OCCNC1=NC2=C(C=CC=C2)C=C1 Z31212267 [0,1,0,0,0,1|2,0,0]=4 367 B15R2.886 CCCC1=CC(=O)C2=C(N1)C=CC=C2 Z445211724 [0,1,0,0,0,1|2,0,0]=4 368 B15R2.886 CCCC1=NC2=C(C=CC=C2)C(=C1)Cl Z445213508 [0,1,0,0,0,1|2,0,0]=4 369 B15R2.888 CC1=C(C=C2C=CC=CC2=C1)CCN Z4336271310 [0,1,0,0,0,1|1,0,0]=3 370 B15R2.888 CCCC1=C(C=C2C=CC=CC2=C1)O Z1513823533 [0,1,0,0,0,1|2,0,0]=4 371 B15R2.1601 CC(CO)C1=CC2=C(C=CC=C2)C=C1 Z1268632146 [0,1,0,0,0,1|2,0,0]=4 372 B15R2.1601 NCC(O)C1=CC2=C(C=CC=C2)C=C1 Z336086484 [0,1,0,0,0,1|1,0,0]=3 373 B15R2.1668 CC(N)CC1=CC2=C(C=CC=C2)C=C1 Z285143892 [0,1,0,0,0,1|1,0,0]=3 374 B15R2.1668 CC(N)CC1=NC2=C(C=CC=C2)C=C1 Z1696091757 [0,1,0,0,0,1|1,0,0]=3 375 B15R2.1668 N=C(N)CC1=NC2=C(C=CC=C2)C=C1 Z1272056498 [0,1,0,0,0,1|1,0,1]=4 376 B15R2.1668 NC(=O)CC1=CC2=C(C=CC=C2)C=C1 Z33546100 [0,1,0,0,0,1|1,0,1]=4 377 B15R2.2220 NCCN1C=NC2=C(C1=O)C=CC=C2 Z354004978 [0,1,0,0,0,1|1,0,1]=4 378 B15R2.795 NCCC1=C2C=CC(=O)NC2=CC=C1 Z4623309728 [0,1,0,0,0,1|2,0,0]=4 379 B15R2.9941 NCCN1C(=O)COC2=C1C=CC=C2 Z1695669928 [0,1,0,0,0,1|2,0,0]=4 380 B15R2.9941 O=C1NCC2=C(N1CCO)C=CC=C2 Z1127315179 [0,1,0,0,0,1|2,0,0]=4 381 B15R2.18471 BrCCCC1=C2C=CC=CC2=CC=C1 Z993019496 [0,1,0,0,0,1|2,0,0]=4 382 B15R2.18471 CCCNC1=C2C=CC=CC2=CC=C1 Z334888486 [0,1,0,0,0,1|2,0,0]=4 383 B15R2.18471 CNCCC1=C2C=CC=CC2=CC=C1 Z385447156 [0,1,0,0,0,1|1,0,0]=3 384 B15R2.18471 NCCCC1=C2C=CC=CC2=CC=C1 Z4824791602 [0,1,0,0,0,1|1,0,0]=3 385 B15R2.18471 NCCNC1=C2C=CC=CC2=CC=C1 Z104474916 [0,1,0,0,0,1|1,0,0]=3 386 B15R2.18471 NCCOC1=C2C=CC=CC2=CC=C1 Z600428460 [0,1,0,0,0,1|1,0,0]=3 387 B15R2.18471 OCCCC1=C2C=CC=CC2=CC=C1 Z993012474 [0,1,0,0,0,1|2,0,0]=4 388 B15R2.18471 OCCOC1=C2C=CC=CC2=NC=C1 Z1255367730 [0,1,0,0,0,1|1,0,1]=4 389 B15R2.79765 NCC(=O)C1=C2C=CC=CC2=CC=C1 Z992716868 [0,1,0,0,0,1|1,0,1]=4 390 B15R2.79765 NCC(O)C1=C2C=CC=CC2=CC=C1 Z336086540 [0,1,0,0,0,1|1,0,0]=3 391 B15R2.4 CNC(=O)CC1=CNC2=C1C=CC=N2 Z1400782245 [0,2,0,0,0,0|1,0,1]=4 392 B15R2.4 COC(=O)CC1=CNC2=C1C=CC=C2 Z18279395 [0,2,0,0,0,0|1,0,1]=4 393 B15R2.4 NC(CO)CC1=CNC2=C1C=CC=C2 Z1069312128 [0,2,0,0,0,0|0,0,0]=2 394 B15R2.4 NNC(=O)CC1=CNC2=C1C=CC=C2 Z56939166 [0,2,0,0,0,0|0,0,1]=3 395 B15R2.4 O=C(CC1=CNC2=C1C=CC=C2)NO Z59181979 [0,2,0,0,0,0|0,0,1]=3 396 B15R2.377 CC1=CC2=C(C=C1)C(=CN2)CC(=O)O Z940713560 [0,2,0,0,0,0|1,0,1]=4 397 B15R2.377 CN(C)CC1=CNC2=C1C=CC(=C2)F Z1201618423 [0,2,0,0,0,0|2,0,0]=4 398 B15R2.377 NC(=O)CC1=CNC2=C1C=CC(=C2)F Z997948672 [0,2,0,0,0,0|0,0,1]=3 399 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Br Z978942580 [0,2,0,0,0,0|1,0,1]=4 400 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)Cl Z940713564 [0,2,0,0,0,0|1,0,1]=4 401 B15R2.377 O=C(O)CC1=CNC2=C1C=CC(=C2)F Z927291412 [0,2,0,0,0,0|1,0,1]=4 402 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)N Z339563896 [0,2,0,0,0,0|0,0,1]=3 403 B15R2.993 CC1=C(C2=C(N1)C=CC=C2)CC(=O)O Z335447192 [0,2,0,0,0,0|1,0,1]=4 404 B15R2.1255 CC(C)C(=O)C1=CNC2=C1C=CC=C2 Z57504508 [0,2,0,0,0,0|1,0,1]=4 405 B15R2.1255 CC(Cl)C(=O)C1=CNC2=C1C=CC=C2 Z57033966 [0,2,0,0,0,0|1,0,1]=4 406 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)F Z1198156503 [0,2,0,0,0,0|0,0,0]=2 407 B15R2.9410 CC(N)CC1=CNC2=C1C=C(C=C2)O Z1255489555 [0,2,0,0,0,0|0,0,0]=2 408 B15R2.9410 CC(N)CC1=CSC2=C1C=C(C=C2)Br Z4631838934 [0,2,0,0,0,0|1,0,0]=3 409 B15R2.9410 CC(N)CC1=CSC2=C1C=C(C=C2)O Z4560488456 [0,2,0,0,0,0|1,0,0]=3 410 B15R2.9410 CC1=CC2=C(C=C1)NC=C2CC(=O)O Z1138836786 [0,2,0,0,0,0|1,0,1]=4 411 B15R2.9410 CN(C)CC1=CNC2=C1C=C(C=C2)Br Z1269196757 [0,2,0,0,0,0|2,0,0]=4 412 B15R2.9410 O=C(O)CC1=CNC2=C1C=C(C=C2)Cl Z1162450206 [0,2,0,0,0,0|1,0,1]=4 413 B15R2.13587 CC1=C2NC=C(C2=CC=C1)CC(=O)O Z1198148795 [0,2,0,0,0,0|1,0,1]=4 414 B15R2.13587 NC(=O)CC1=CNC2=C1C=CC=C2Br Z1269130594 [0,2,0,0,0,0|0,0,1]=3 415 B15R2.13587 O=C(O)CC1=CNC2=C1C=CC=C2Br Z1269161790 [0,2,0,0,0,0|1,0,1]=4 416 B15R2.13587 O=C(O)CC1=CNC2=C1C=CC=C2F Z1198266463 [0,2,0,0,0,0|1,0,1]=4 417 B15R2.13624 CC1=C2C(=CNC2=CC=C1)CC(=O)O Z978942564 [0,2,0,0,0,0|1,0,1]=4 418 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Br Z1269131875 [0,2,0,0,0,0|1,0,1]=4 419 B15R2.13624 O=C(O)CC1=CNC2=C1C(=CC=C2)Cl Z1269128767 [0,2,0,0,0,0|1,0,1]=4 420 B15R2.5 NCCCCC1=CNC2=C1C=CC=C2 Z3766503508 [0,2,0,0,0,0|0,0,0]=2 421 B15R2.6 CC(=O)CCC1=CNC2=C1C=CC=C2 Z276142282 [0,2,0,0,0,0|1,0,0]=3 422 B15R2.6 CN(C)CCC1=CNC2=C1N=CC=C2 Z5537309001 [0,2,0,0,0,0|1,0,0]=3 423 B15R2.6 N=C(N)NCC1=CSC2=C1C=CC=C2 Z1090048388 [0,2,0,0,0,0|1,0,1]=4 424 B15R2.6 NC(=O)CCC1=CNC2=C1C=CC=C2 Z33546345 [0,2,0,0,0,0|0,0,0]=2 425 B15R2.6 O=C(O)CCC1=CCC2=C1C=CC=C2 Z1262514880 [0,2,0,0,0,0|2,0,0]=4 426 B15R2.6 O=C(O)CCC1=CNC2=C1C=CC=C2 Z104482518 [0,2,0,0,0,0|1,0,0]=3 427 B15R2.6 O=C(O)CCC1=CSC2=C1C=CC=C2 Z995104750 [0,2,0,0,0,0|2,0,0]=4 428 B15R2.73 CC(CCO)C1=CNC2=C1C=CC=C2 Z1262570410 [0,2,0,0,0,0|1,0,0]=3 429 B15R2.73 N#CCC(=O)C1=CNC2=C1C=CC=C2 Z56928903 [0,2,0,0,0,0|0,0,2]=4 430 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)CCC=O Z2750451565 [0,2,0,0,0,0|1,0,0]=3 431 B15R2.1435 CC1=C(C2=C(N1)C=CC=C2)SCCN Z1269201274 [0,2,0,0,0,0|0,0,0]=2 432 B15R2.1435 CC1=NC2=C(N1CCCN)C=CC=C2 Z147642868 [0,2,0,0,0,0|1,0,1]=4 433 B15R2.1435 CCCCN1C(=O)NC2=C1C=CC=C2 Z57369967 [0,2,0,0,0,0|2,0,0]=4 434 B15R2.1435 CNCCN1C(=O)OC2=C1C=CC=C2 Z1266933902 [0,2,0,0,0,0|2,0,0]=4 435 B15R2.1435 NCCCN1C(=O)NC2=C1C=CC=C2 Z3234950107 [0,2,0,0,0,0|1,0,0]=3 436 B15R2.12 CCC1=C2NC=C(C2=CC=C1)CC#N Z978942408 [0,2,0,0,0,0|0,0,2]=4 437 B15R2.12 COC1=C2NC=C(C2=CC=C1)CC#N Z1198165195 [0,2,0,0,0,0|0,0,2]=4 438 B15R2.12 COC1=C2NC=C(C2=CC=C1)CCN Z1192378718 [0,2,0,0,0,0|0,0,0]=2 439 B15R2.2170 O=C(CCl)C1=CNC2=C1C=CC=C2Br Z1269129420 [0,2,0,0,0,0|1,0,1]=4 440 B15R2.10368 NCCC1=CNC2=C1C=C(C=C2Cl)Cl Z2239077736 [0,2,0,0,0,0|0,0,0]=2 441 B15R2.10368 NCCC1=CNC2=C1C=C(C=C2Cl)F Z4097796575 [0,2,0,0,0,0|0,0,0]=2 442 B15R2.10368 NCCC1=CNC2=C1C=C(C=C2F)Cl Z2712264869 [0,2,0,0,0,0|0,0,0]=2 443 B15R2.11815 CC1=C(C2=C(N1)C(=CC=C2)F)CCN Z2106605164 [0,2,0,0,0,0|0,0,0]=2 444 B15R2.11815 CC1=CC=CC2=C1NC(=C2CCN)C Z1198153538 [0,2,0,0,0,0|0,0,0]=2 445 B15R2.2291 CC(C)(C=O)C1=CNC2=C1C=CC=C2 Z3242730782 [0,2,0,0,0,0|1,0,1]=4 446 B15R2.19094 CC(CN)C1=CNC2=C1C=CC(=C2)F Z2738657940 [0,2,0,0,0,0|0,0,0]=2 447 B15R2.19094 O=C(CCl)C1=CNC2=C1C=CC(=C2)Br Z916008156 [0,2,0,0,0,0|1,0,1]=4 448 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)C(=O)CBr Z381424866 [0,2,0,0,0,0|1,0,1]=4 449 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)C(=O)CCl Z56846727 [0,2,0,0,0,0|1,0,1]=4 450 B15R2.19393 CC1=C(C2=C(N1)C=CC=C2)C(O)CN Z363991722 [0,2,0,0,0,0|0,0,0]=2 451 B15R2.23388 CN1C=C(C2=C1C=CC=C2)C(=O)CCl Z381354466 [0,2,0,0,0,0|1,0,1]=4 452 B15R2.23388 CN1C=C(C2=C1C=CC=C2)C(=O)NN Z89300755 [0,2,0,0,0,0|1,0,1]=4 453 B15R2.79417 O=C(CCl)C1=CNC2=C1C=C(C=C2)Br Z382706238 [0,2,0,0,0,0|1,0,1]=4 454 B15R2.79417 O=C(CCl)C1=CNC2=C1C=C(C=C2)F Z1160902697 [0,2,0,0,0,0|1,0,1]=4 455 B15R2.79451 CC1=C2C(=CC=C1)NC=C2C(=O)CCl Z385443974 [0,2,0,0,0,0|1,0,1]=4 456 B15R2.79451 O=C(CCl)C1=CNC2=C1C(=CC=C2)Br Z1269208264 [0,2,0,0,0,0|1,0,1]=4 457 B15R2.10356 COC1=CC2=C(C=C1)C(=CN2)CC#N Z1198154109 [0,2,0,0,0,0|0,0,2]=4 458 B15R2.10356 COC1=CC2=C(C=C1)C(=CN2)CCN Z1203162607 [0,2,0,0,0,0|0,0,0]=2 459 B15R2.11494 CC1=CC2=C(C=C1)C(=CN2C)CC#N Z1255381274 [0,2,0,0,0,0|0,0,2]=4 460 B15R2.11494 CC1=CC2=C(C=C1)C(=CN2C)CCN Z1753032801 [0,2,0,0,0,0|0,0,0]=2 461 B15R2.11494 CN1C=C(C2=C1C=C(C=C2)Cl)CC#N Z1416173233 [0,2,0,0,0,0|0,0,2]=4 462 B15R2.11494 CN1C=C(C2=C1C=C(C=C2)Cl)CCN Z1753012997 [0,2,0,0,0,0|0,0,0]=2 463 B15R2.11812 CC1=C(C2=C(N1)C=C(C=C2)F)CCN Z2681892967 [0,2,0,0,0,0|0,0,0]=2 464 B15R2.11812 CC1=C(C2=C(O1)C=C(C=C2)F)CCN Z4436579675 [0,2,0,0,0,0|1,0,0]=3 465 B15R2.11812 CC1=C(C2=C(S1)C=C(C=C2)F)CCN Z4460065189 [0,2,0,0,0,0|1,0,0]=3 466 B15R2.11812 CC1=CC2=C(C=C1)C(=C(O2)C)CCN Z4437829413 [0,2,0,0,0,0|1,0,0]=3 467 B15R2.11812 CC1=NC2=C(N1CCN)C=CC(=C2)Cl Z4438637066 [0,2,0,0,0,0|1,0,1]=4 468 B15R2.11812 NCCC1C(=O)NC2=C1C=CC(=C2)Cl Z3686652675 [0,2,0,0,0,0|0,0,1]=3 469 B15R2.11812 NCCN1C(=O)NC2=C1C=CC(=C2)Cl Z4445880318 [0,2,0,0,0,0|1,0,0]=3 470 B15R2.54409 CC1=C(C=C2NC=C(C2=C1)CCN)F Z2737748804 [0,2,0,0,0,0|0,0,0]=2 471 B15R2.54409 N#CCC1=CNC2=CC(=C(C=C12)F)F Z1198266462 [0,2,0,0,0,0|0,0,2]=4 472 B15R2.54425 NCCC1=CNC2=C1C(=CC(=C2)Cl)Cl Z1486037041 [0,2,0,0,0,0|0,0,0]=2 473 B15R2.54425 NCCC1=CNC2=C1C(=CC(=C2)F)F Z2724336926 [0,2,0,0,0,0|0,0,0]=2 474 B15R2.728 NCCN1C2=C(C=CC=C2)NS1(=O)=O Z1737940643 [0,2,0,0,0,0|2,0,0]=4 475 B15R2.56716 CC1=C(C2=C(N1)C=CC=C2Cl)CCN Z4085233059 [0,2,0,0,0,0|0,0,0]=2 476 B15R2.56716 CC1=C2C(=CC=C1)NC(=O)C2CCN Z4607148565 [0,2,0,0,0,0|0,0,1]=3 477 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Br)CCN Z1269215008 [0,2,0,0,0,0|0,0,0]=2 478 B15R2.56717 CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN Z2106605201 [0,2,0,0,0,0|0,0,0]=2 479 B15R2.56717 CC1=CC2=C(C=C1)NC(=C2CCN)C Z1198153447 [0,2,0,0,0,0|0,0,0]=2 480 B15R2.56717 NCCC1C(=O)NC2=C1C=C(C=C2)F Z1993522713 [0,2,0,0,0,0|0,0,1]=3 481 B15R2.54408 COC1=C2C(=CNC2=CC=C1)CC#N Z1198222836 [0,2,0,0,0,0|0,0,2]=4 482 B15R2.54408 COC1=C2C(=CNC2=CC=C1)CCN Z2760930347 [0,2,0,0,0,0|0,0,0]=2 483 B15R2.54412 COC1=CC2=C(C=C1)NC=C2CC#N Z410711518 [0,2,0,0,0,0|0,0,2]=4 484 B15R2.54412 COC1=CC2=C(C=C1)NC=C2CCN Z336079372 [0,2,0,0,0,0|0,0,0]=2 485 B13R2.3 C1=CC(=CN=C1)C2=CCNCC2 Z1558572494 [0,0,1,1,0,0|2,0,0]=4 486 B13R2.3 C1=CC=C(C=C1)C2=CCNCC2 Z1742056028 [0,0,1,1,0,0|1,0,0]=3 487 B13R2.15 N=C1NCCC1C2=CC=CC=C2 Z5485653209 [0,0,1,1,0,0|0,0,2]=4 488 B13R2.15 NC1=C(C=NN1)C2=CC=CC=C2 Z57912392 [0,0,1,1,0,0|1,0,1]=4 489 B13R2.15 NC1=NCCN1C2=CC=CC=C2 Z56767233 [0,0,1,1,0,0|1,0,1]=4 490 B13R2.15 O=C1NCCC1C2=CC=CC=C2 Z1198157720 [0,0,1,1,0,0|1,0,1]=4 491 B13R2.15 O=C1NCCN1C2=CC=CC=C2 Z1201621797 [0,0,1,1,0,0|2,0,0]=4 492 B13R2.373 NC1CN(C1=O)C2=CC=CC=C2 Z1891776032 [0,0,1,1,0,0|2,0,0]=4 493 B13R2.1613 N/N=C\1/CCCC2=C1C=CC=C2 Z56931840 [0,0,1,1,0,0|2,0,0]=4 494 B13R2.64 C1=CC=C(C=C1)CC2=NCCN2 Z1255415487 [0,0,1,1,0,0|2,0,0]=4 495 B13R2.64 C1=CC=C(C=C1)NC2=NCCS2 Z56755591 [0,0,1,1,0,0|1,0,1]=4 496 B13R2.57 NCC1=CC2=C(C=CC=C2)C=C1 Z406680048 [0,0,1,1,0,0|1,0,1]=4 497 B13R2.57 NCC1=CC2=C(C=CC=C2)N=C1 Z1365534657 [0,0,1,1,0,0|0,0,2]=4 498 B13R2.26 NCCC1=CC2=C(N1)C=CC=C2 Z1198165410 [0,0,1,1,0,0|2,0,0]=4 499 B13R2.26 NCCC1=CC2=C(O1)C=CC=C2 Z1250132703 [0,0,1,1,0,0|2,0,0]=4 500 B13R2.26 NCCC1=CN2C=CC=NC2=N1 Z2582143859 [0,0,1,1,0,0|2,0,0]=4 501 B13R2.26 OCCC1=CN2C=CC=CC2=N1 Z1255417188 [0,0,1,1,0,0|2,0,0]=4 502 B13R2.292 CNCC1=C2NC=CC2=CC=C1 Z1137726171 [0,0,1,1,0,0|2,0,0]=4 503 B13R2.449 NCCC1=CC2=C(C=C1)OC=C2 Z4327136974 [0,0,1,1,0,0|2,0,0]=4 504 B13R2.449 NCCC1=CC2=C(C=C1)SC=C2 Z4692024239 [0,0,1,1,0,0|2,0,0]=4 505 B13R2.449 NCCC1=CC2=C(C=CN2)C=C1 Z1198178617 [0,0,1,1,0,0|2,0,0]=4 506 B13R2.4818 NC1=C2C(=O)CCCC2=CC=C1 Z1198176378 [0,0,1,1,0,0|2,0,0]=4 507 B13R2.4818 O=C1CCNC2=CC=CC(=C12)Br Z1551954396 [0,0,1,1,0,0|2,0,0]=4 508 B13R2.4818 O=C1CCNC2=CC=CC(=C12)F Z1198730158 [0,0,1,1,0,0|2,0,0]=4 509 B15R3.4266 C1=CC2=C(C=C1)NC3=NCCN3C2 Z2092177512 [0,0,0,1,0,1|1,0,1]=4 510 B15R3.31603 C1=CC2=C(C=C1)C=C(C=C2)C3CO3 Z278165208 [0,0,0,1,0,1|2,0,0]=4 511 B15R3.1743 C1=CC2=CC=CC(=C2C=C1)[C@@H]3CO3 Z1575341744 [0,0,0,1,0,1|2,0,0]=4 512 B15R3.2009 O=C1CC2=C(C1)C3=C(N2)C=CC=C3 Z1255384489 [0,1,0,1,0,0|1,0,1]=4 513 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CCNC3 Z203053856 [0,1,0,1,0,0|1,0,0]=3 514 B15R3.3 C1=CC2=C(C=C1)C3=C(N2)CNCC3 Z1526503389 [0,1,0,1,0,0|0,0,0]=2 515 B15R3.3 C1=CC2=C(C=C1)N3CCCNC3=N2 Z1198155825 [0,1,0,1,0,0|1,0,1]=4 516 B15R3.3 C1=CC2=C(C=C1)N3CCNCC3=C2 Z2188172213 [0,1,0,1,0,0|2,0,0]=4 517 B15R3.3 C1=CC2=C(N=C1)NC3=C2CCCC3 Z1198153889 [0,1,0,1,0,0|2,0,0]=4 518 B15R3.1738 C1=CC2=C(C=C1)C3(CCNC3)CN2 Z2143576554 [0,1,0,1,0,0|0,0,2]=4 519 B15R3.562 BrC1=C2NC3=C(C2=CC=C1)CCC3 Z1259160613 [0,1,0,1,0,0|1,0,0]=3 520 B15R3.656 O=C1NC2=C(N1C3CC3)C=CC=C2 Z1198180840 [0,1,0,1,0,0|2,0,0]=4 521 B15R3.10821 BrC1=CC2=C(C=C1)NC=C2C3CC3 Z1551930833 [0,1,0,1,0,0|1,0,0]=3 522 B11R2.988 NCC1CC2=C1C=CC=C2 Z234895091 [1,0,0,0,1,0|0,0,2]=4 523 B13R1.470 CCCC(=O)NC1=C(C=CC=C1)N Z1455911296 [0,0,1,0,0,1|2,0,0]=4 524 B13R1.470 NCCC(=O)NC1=C(C=CC=C1)Br Z4663226499 [0,0,1,0,0,1|2,0,0]=4