0 B12R1.286 COC1=C(F)C=CC(CC#N)=C1 3140AC [0,0,0,0,0,0|2,0,2]=4 1 B11R1.189 C=CCC1=CC(OC)=CC=C1 8319AD [1,0,0,0,0,0|0,0,2]=3 2 B11R1.189 CNCC1=CC(OC)=CC=C1 5753AB [1,0,0,0,0,0|1,0,1]=3 3 B11R1.189 COC1=CC(CCBr)=CC=C1 7285AD [1,0,0,0,0,0|1,0,2]=4 4 B11R1.189 COC1=CC(CCO)=CC=C1 6862AB [1,0,0,0,0,0|1,0,2]=4 5 B11R1.189 COC1=CC(\C=N\O)=CC=C1 2173AE [1,0,0,0,0,0|2,0,0]=3 6 B11R1.192 CC1=CC(SC#N)=CC=C1O 4825AB [1,0,0,0,0,0|2,0,1]=4 7 B11R1.192 CCOC1=CC=C(Br)C(C)=C1 W7841 [1,0,0,0,0,0|2,0,1]=4 8 B11R1.192 CNCC1=CC(C)=C(C)C=C1 8414AA [1,0,0,0,0,0|2,0,1]=4 9 B11R1.192 CNCC1=CC=C(O)C(O)=C1 6058AJ [1,0,0,0,0,0|1,0,1]=3 10 B11R1.280 COC1=CC(C#N)=CC=C1Br X9417 [1,0,0,0,0,0|2,0,1]=4 11 B11R1.280 COC1=CC(C#N)=CC=C1Cl 6137AJ [1,0,0,0,0,0|2,0,1]=4 12 B11R1.280 COC1=CC(C=O)=CC=C1C L541 [1,0,0,0,0,0|2,0,0]=3 13 B11R1.280 COC1=CC(CBr)=CC=C1Cl Z3822 [1,0,0,0,0,0|2,0,1]=4 14 B11R1.280 COC1=CC(CO)=C(O)C=C1 9894AL [1,0,0,0,0,0|3,0,0]=4 15 B11R1.280 COC1=CC(CO)=CC=C1F X8133 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.280 COC1=CC(OC)=C(C)C=C1 2048AE [1,0,0,0,0,0|2,0,0]=3 17 B11R1.280 COC1=CC=C(F)C(OC)=C1 W3867 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.280 COC1=CC=C(O)C(C#N)=C1 2091AL [1,0,0,0,0,0|3,0,0]=4 19 B11R1.280 COC1=CC=C(O)C(OC)=C1 X9852 [1,0,0,0,0,0|1,0,0]=2 20 B13R1.49 CCC(=O)C1=CC=C(O)C(OC)=C1 Q284 [0,1,0,0,0,0|0,0,1]=2 21 B13R1.49 COC(=O)C1=CC(OC)=C(Cl)N=C1 5376AC [0,1,0,0,0,0|3,0,0]=4 22 B13R1.49 COC(=O)C1=CC=C(Br)C(OC)=N1 3826AA [0,1,0,0,0,0|3,0,0]=4 23 B13R1.49 COC(=O)C1=CC=C(F)C(OC)=C1 1552AC [0,1,0,0,0,0|2,0,0]=3 24 B13R1.49 COC(=O)C1=CC=C(O)C(C#N)=C1 Y7652 [0,1,0,0,0,0|3,0,0]=4 25 B13R1.52 COC1=CC(CC(=O)O)=CC=C1F X2685 [0,1,0,0,0,0|2,0,1]=4 26 B13R1.52 COC1=CC(CC(C)=O)=CC=C1O L729 [0,1,0,0,0,0|0,0,1]=2 27 B13R1.52 COC1=CC(NC(C)=O)=CC=C1Cl V9910 [0,1,0,0,0,0|2,0,0]=3 28 B13R1.386 CNCC1=CC(OC)=C(OC)C=C1 9718AB [0,1,0,0,0,0|1,0,1]=3 29 B13R1.575 COC1=C(O)C=CC(CCCO)=C1 1487AB [0,1,0,0,0,0|0,0,2]=3 30 B13R2.449 CCNC1=CC=C2OCOC2=C1 M758 [0,0,0,1,0,0|1,0,1]=3 31 B13R2.449 CNCC1=CC=C2OCOC2=C1 7717AB [0,0,0,1,0,0|1,0,1]=3 32 B13R2.449 NCCC1=CC2=C(C=C1)OCO2 5304AD [0,0,0,1,0,0|1,0,2]=4 33 B10R1.10 CCNC1=CC=CC(O)=C1 9329AB [2,0,0,0,0,0|1,0,1]=4 34 B10R1.10 CNCC1=CC=CC(C)=C1 5109AB [2,0,0,0,0,0|1,0,1]=4 35 B10R1.172 C#CC1=CC(OC)=CC=C1 X7096 [2,0,0,0,0,0|0,0,2]=4 36 B10R1.172 C=CC1=CC(OC)=CC=C1 9451AB [2,0,0,0,0,0|0,0,0]=2 37 B10R1.172 CCC1=CC(C=O)=CC=C1 Z4620 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.172 COC1=CC(C=O)=NC=C1 8539AA [2,0,0,0,0,0|2,0,0]=4 39 B10R1.172 COC1=CC(SC)=CC=C1 U812 [2,0,0,0,0,0|1,0,0]=3 40 B10R1.172 COC1=CN=CC(C=O)=C1 X9038 [2,0,0,0,0,0|2,0,0]=4 41 B10R1.172 COC1=CN=CC(OC)=C1 W4037 [2,0,0,0,0,0|2,0,0]=4 42 B10R1.172 COC1=NC=CC(C=O)=C1 W8122 [2,0,0,0,0,0|2,0,0]=4 43 B10R1.176 CC1=CC(C=O)=CC=C1Cl Y3523 [2,0,0,0,0,0|2,0,0]=4 44 B10R1.176 CCC1=CC(Br)=C(O)C=C1 7273AE [2,0,0,0,0,0|1,0,1]=4 45 B10R1.176 CCC1=CC(O)=C(O)C=C1 2184AA [2,0,0,0,0,0|0,0,1]=3 46 B10R1.176 CCC1=CC=C(N)C(O)=C1 1522AJ [2,0,0,0,0,0|1,0,1]=4 47 B10R1.176 COC1=CC(N)=C(O)C=C1 0175AE [2,0,0,0,0,0|2,0,0]=4 48 B10R1.176 COC1=CC(O)=C(N)C=C1 5590AB [2,0,0,0,0,0|2,0,0]=4 49 B10R1.176 COC1=CC=C(Br)C(O)=C1 W7550 [2,0,0,0,0,0|2,0,0]=4 50 B10R1.176 COC1=CC=C(F)C(C)=C1 1547AB [2,0,0,0,0,0|2,0,0]=4 51 B10R1.176 COC1=CC=C(F)C(O)=C1 Y3754 [2,0,0,0,0,0|2,0,0]=4 52 B10R1.176 COC1=CC=C(I)C(O)=C1 5618AB [2,0,0,0,0,0|2,0,0]=4 53 B10R1.176 COC1=CC=C(N)C(O)=C1 Z4697 [2,0,0,0,0,0|2,0,0]=4 54 B10R1.176 COC1=CC=C(O)C(C)=C1 Y5462 [2,0,0,0,0,0|1,0,0]=3 55 B10R1.176 O=CC1=CC=C(Br)C(O)=C1 V4155 [2,0,0,0,0,0|2,0,0]=4 56 B10R1.176 OCC1=CC(O)=C(O)C=C1 5062AB [2,0,0,0,0,0|1,0,1]=4 57 B10R1.30 CC1=CC(CO)=C(O)C=C1 9929AL [2,0,0,0,0,0|2,0,0]=4 58 B10R1.30 CCC1=C(O)C=CC(C)=N1 R736 [2,0,0,0,0,0|2,0,0]=4 59 B10R1.30 CCC1=CC(F)=CC=C1O 5252AB [2,0,0,0,0,0|2,0,0]=4 60 B10R1.30 COC1=C(C)C=CC(C)=C1 8752AA [2,0,0,0,0,0|1,0,0]=3 61 B10R1.30 COC1=C(C)C=CC(I)=C1 5867AH [2,0,0,0,0,0|2,0,0]=4 62 B10R1.30 COC1=C(F)C=CC(C)=C1 9757AB [2,0,0,0,0,0|1,0,0]=3 63 B10R1.30 COC1=C(F)C=CC(I)=C1 2100AC [2,0,0,0,0,0|2,0,0]=4 64 B10R1.30 COC1=C(N)C=CC(O)=C1 6080AJ [2,0,0,0,0,0|2,0,0]=4 65 B10R1.30 COC1=C(O)C=CC(I)=C1 2745AL [2,0,0,0,0,0|1,0,0]=3 66 B10R1.30 COC1=CC(C)=CC=C1Br X8417 [2,0,0,0,0,0|1,0,0]=3 67 B10R1.30 COC1=CC(C)=CC=C1Cl Y6374 [2,0,0,0,0,0|1,0,0]=3 68 B10R1.30 COC1=CC(C)=CC=C1N V7435 [2,0,0,0,0,0|1,0,0]=3 69 B10R1.30 COC1=CC(Cl)=CC=C1F Y5128 [2,0,0,0,0,0|2,0,0]=4 70 B10R1.30 COC1=CC(Cl)=CC=C1I W8277 [2,0,0,0,0,0|2,0,0]=4 71 B10R1.30 COC1=CC(F)=CC=C1N V3864 [2,0,0,0,0,0|2,0,0]=4 72 B10R1.30 COC1=CC(F)=CC=C1O L719 [2,0,0,0,0,0|1,0,0]=3 73 B10R1.30 COC1=CC(I)=CC=C1Cl X8154 [2,0,0,0,0,0|2,0,0]=4 74 B10R1.30 COC1=CC(N)=CC=C1C W3586 [2,0,0,0,0,0|2,0,0]=4 75 B10R1.30 COC1=CC(O)=CC=C1Cl X4399 [2,0,0,0,0,0|2,0,0]=4 76 B10R1.30 COC1=CC(O)=CC=C1N 9246AB [2,0,0,0,0,0|2,0,0]=4 77 B10R1.30 COC1=NC(C)=CC=C1Br V7464 [2,0,0,0,0,0|2,0,0]=4 78 B12R1.382 COC1=CC=CC(OCCN)=C1 9926AB [1,1,0,0,0,0|1,0,1]=4 79 B12R1.435 COC(=O)C1=CC(OC)=NC=C1 Z0439 [1,1,0,0,0,0|2,0,0]=4 80 B12R1.435 COC(=O)C1=NC=CC(OC)=C1 W5213 [1,1,0,0,0,0|2,0,0]=4 81 B12R1.438 COC1=CC(NC(N)=O)=CC=C1 W3057 [1,1,0,0,0,0|2,0,0]=4 82 B12R1.438 COC1=CC=CC(CC(=N)N)=C1 7392AE [1,1,0,0,0,0|1,0,1]=4 83 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 9530AD [1,1,0,0,0,0|0,0,1]=3 84 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 1466AE [1,1,0,0,0,0|1,0,1]=4 85 B12R1.438 COC1=CC=CC(NC(=N)N)=C1 8358AB [1,1,0,0,0,0|2,0,0]=4 86 B12R1.438 COC1=CC=CC(NC(C)=O)=C1 6150AE [1,1,0,0,0,0|1,0,0]=3 87 B12R1.19 CC(=O)NC1=CC=C(O)C(Cl)=C1 W5998 [1,1,0,0,0,0|2,0,0]=4 88 B12R1.19 CC1=C(O)C=CC(CC(=O)O)=C1 2940AB [1,1,0,0,0,0|1,0,1]=4 89 B12R1.367 COC(=O)C1=CC(C)=C(C)C=C1 4972AB [1,1,0,0,0,0|2,0,0]=4 90 B12R1.367 COC(=O)C1=CC=C(F)C(O)=C1 Z0379 [1,1,0,0,0,0|2,0,0]=4 91 B12R1.367 COC(=O)C1=CC=C(I)C(O)=C1 W3431 [1,1,0,0,0,0|2,0,0]=4 92 B12R1.367 COC(=O)C1=CC=C(O)C(I)=C1 W3304 [1,1,0,0,0,0|2,0,0]=4 93 B12R1.367 O=C(NO)C1=CC(O)=C(O)C=C1 1716AH [1,1,0,0,0,0|2,0,0]=4 94 B12R1.56 COC1=C(Br)C=CC(C(C)=O)=C1 X3797 [1,1,0,0,0,0|1,0,0]=3 95 B12R1.56 COC1=C(I)C=CC(C(=O)O)=C1 9083AD [1,1,0,0,0,0|2,0,0]=4 96 B12R1.56 COC1=C(O)C=CC(C(=O)[O-])=C1 8979AL [1,1,0,0,0,0|1,0,0]=3 97 B12R1.56 COC1=C(O)C=CC(C(C)O)=C1 1912AB [1,1,0,0,0,0|0,0,1]=3 98 B12R1.56 COC1=CC(B(O)O)=CC=C1O V3926 [1,1,0,0,0,0|2,0,0]=4 99 B12R1.56 COC1=CC(C(=O)O)=CN=C1O Z7814 [1,1,0,0,0,0|2,0,0]=4 100 B12R1.56 COC1=CC(C(C)=O)=CC=C1F W7603 [1,1,0,0,0,0|1,0,0]=3 101 B12R1.78 C#CC1=CC=C(OC)C(OC)=C1 W6255 [1,1,0,0,0,0|0,0,2]=4 102 B12R1.300 COC1=C(O)C(F)=CC(C=O)=C1 W8496 [1,1,0,0,0,0|1,0,0]=3 103 B12R1.300 COC1=CC(C#N)=CC(Br)=C1O 4991AE [1,1,0,0,0,0|1,0,1]=4 104 B12R1.449 CNC1=CC(OC)=C(Cl)C=C1Cl Z7001 [1,1,0,0,0,0|2,0,0]=4 105 B12R1.449 COC1=CC(C=O)=C(F)C=C1F 5341AJ [1,1,0,0,0,0|2,0,0]=4 106 B12R1.449 COC1=CC(C=O)=C(O)C=C1O 4923AH [1,1,0,0,0,0|1,0,0]=3 107 B12R1.453 CCC1=CC=C(O)C(C(C)=O)=C1 5843AH [1,1,0,0,0,0|1,0,1]=4 108 B14R1.41 COC1=C(O)C=CC(C(O)C(=O)O)=C1 8088AF [0,2,0,0,0,0|1,0,1]=4 109 B14R1.626 CCOC(=O)C1=CC=C(N)C(OC)=C1 1396AC [0,2,0,0,0,0|1,0,1]=4 110 B14R1.1864 COC(=O)C1=CC(OC)=C(C=O)C=C1 3567AL [0,2,0,0,0,0|1,0,1]=4 111 B14R1.343 COC1=CC(CN(C)C)=CC(F)=C1O Y3577 [0,2,0,0,0,0|1,0,1]=4 112 B14R1.439 CCOC1=CC(CC(=O)O)=CC=C1O 9914AE [0,2,0,0,0,0|1,0,1]=4 113 B14R1.705 CC(=O)NC1=CC=C(O)C(C(C)=O)=C1 Y9932 [0,2,0,0,0,0|2,0,0]=4 114 B14R1.3651 COC1=CC=C(CC(=N)N)C=C1OC 3095AH [0,2,0,0,0,0|1,0,1]=4 115 B14R1.3651 COC1=CC=C(CC(N)=S)C=C1OC 7750AJ [0,2,0,0,0,0|1,0,1]=4 116 B14R1.793 CNCCC1=CC=C(OC)C(OC)=C1 C344 [0,2,0,0,0,0|0,0,2]=4 117 B14R1.42 COC1=C(O)C=CC(\C=C\[N+](=O)[O-])=C1 9265AB [0,2,0,0,0,0|1,0,0]=3 118 B14R1.3236 C=CCC1=CC(OC)=C(O)C(C=O)=C1 6747AL [0,2,0,0,0,0|0,0,2]=4 119 B12R2.44 COC1=CC2=C(C=C1)CCN2 V2361 [1,0,0,1,0,0|1,0,1]=4 120 B12R2.44 COC1=CC2=C(C=C1)CNC2 X9691 [1,0,0,1,0,0|1,0,1]=4 121 B12R2.44 COC1=CC2=C(C=C1)CNC2 Z3916 [1,0,0,1,0,0|1,0,1]=4 122 B12R2.44 COC1=CC2=C(C=C1)OC=C2 6140AA [1,0,0,1,0,0|1,0,0]=3 123 B12R2.44 COC1=CC2=C(C=C1)SC=N2 2987AB [1,0,0,1,0,0|2,0,0]=4 124 B12R2.44 COC1=CC2=C(C=CC2)C=C1 4207AB [1,0,0,1,0,0|0,0,2]=4 125 B12R2.44 COC1=CC2=C(C=CS2)C=C1 5075AC [1,0,0,1,0,0|1,0,1]=4 126 B12R2.44 COC1=CC=C2C=COC2=C1 6968AB [1,0,0,1,0,0|1,0,1]=4 127 B12R2.44 COC1=CC=C2N=CSC2=C1 W5194 [1,0,0,1,0,0|2,0,0]=4 128 B12R2.44 COC1=CC=C2NC=CC2=N1 W3769 [1,0,0,1,0,0|2,0,0]=4 129 B12R2.44 COC1=CN2C=CN=C2C=C1 V9621 [1,0,0,1,0,0|2,0,0]=4 130 B12R2.315 COC1=CC=CC2=C1CCN2 5089AC [1,0,0,1,0,0|1,0,1]=4 131 B12R2.315 COC1=CC=CC2=C1CCN2 Y4009 [1,0,0,1,0,0|1,0,1]=4 132 B12R2.315 COC1=CC=CC2=C1CNC2 Z3970 [1,0,0,1,0,0|1,0,1]=4 133 B12R2.315 COC1=CC=CC2=C1NN=C2 Y7436 [1,0,0,1,0,0|2,0,0]=4 134 B12R2.100 CC1=CC2=C(C=C1Br)NC=C2 Z4495 [1,0,0,1,0,0|2,0,0]=4 135 B12R2.100 CC1=CC2=C(C=C1Cl)NC=C2 8209AA [1,0,0,1,0,0|2,0,0]=4 136 B12R2.100 OC1=CC2=C(C=C1O)NC=C2 Z1653 [1,0,0,1,0,0|1,0,0]=3 137 B14R2.966 COC(=O)C1=CC2=C(C=C1)OCC2 6231AE [0,1,0,1,0,0|2,0,0]=4 138 B14R2.966 COC(=O)C1=CC2=C(C=C1)OCO2 3664AB [0,1,0,1,0,0|1,0,0]=3 139 B14R2.966 NNC(=O)C1=CC=C2OCOC2=C1 X8214 [0,1,0,1,0,0|2,0,0]=4 140 B14R2.2167 COC1=C(I)C=C2CCC(=O)C2=C1 1162AQ [0,1,0,1,0,0|1,0,1]=4 141 B14R2.2167 COC1=CC2=C(C=C1Cl)CCC2=O 4141AB [0,1,0,1,0,0|1,0,1]=4 142 B14R2.112 CNCC1=CC2=C(C=C1)OCCO2 9194AB [0,1,0,1,0,0|1,0,1]=4 143 B14R2.112 O\N=C\C1=CC=C2OCCOC2=C1 Z1940 [0,1,0,1,0,0|2,0,0]=4 144 B14R2.82 COC1=C(OC)C=C2NC=NC2=C1 1280AC [0,1,0,1,0,0|2,0,0]=4 145 B14R2.203 COC1=C2C=CC=CC2=CC=C1Br W7408 [0,1,0,1,0,0|1,0,1]=4 146 B14R2.991 OCCNC1=CC=C2OCOC2=C1 Z5371 [0,1,0,1,0,0|1,0,1]=4