0 B9R1.35 CC(=O)C1=CC(Cl)=CS1 W5634 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 CC(=O)C1=CC=C(Br)O1 3520AB [0,0,0,0,0,0|1,0,0]=1 2 B9R1.35 CC(=O)C1=CSC(Cl)=C1 Z0709 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.35 CC(=O)C1=NC(C)=CO1 5140AC [0,0,0,0,0,0|2,0,0]=2 4 B9R1.35 CC(=O)C1=NC=C(Br)S1 2132AC [0,0,0,0,0,0|2,1,0]=3 5 B9R1.35 CC(=O)C1=NC=C(C)S1 Y9563 [0,0,0,0,0,0|1,1,0]=2 6 B9R1.35 CC(=O)C1=NN(C)C=C1 2329AL [0,0,0,0,0,0|2,0,0]=2 7 B9R1.35 CC(N)C1=CC=C(Cl)S1 7287AD [0,0,0,0,0,0|2,1,1]=4 8 B9R1.35 CC1=CC=C(C(C)N)O1 7302AE [0,0,0,0,0,0|1,0,1]=2 9 B9R1.35 CC1=CN=C(C(=O)O)O1 X6429 [0,0,0,0,0,0|2,0,0]=2 10 B9R1.35 CC1=CNC(C(=O)O)=C1 V0508 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.35 CC1=CNC(C(=O)O)=N1 Y9876 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 CC1=CNC(C(C)C)=N1 1747AJ [0,0,0,0,0,0|3,0,1]=4 13 B9R1.35 CC1=NC(C(=O)O)=CO1 V4541 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.35 CC1=NC(C(=O)O)=NO1 6632AD [0,0,0,0,0,0|4,0,0]=4 15 B9R1.35 CC1=NC(C(=O)[O-])=NO1 0567AB [0,0,0,0,0,0|4,0,0]=4 16 B9R1.35 CC1=NC(C(C)N)=CS1 0056AE [0,0,0,0,0,0|3,0,1]=4 17 B9R1.35 CC1=NC(C(N)=O)=CS1 Y5140 [0,0,0,0,0,0|3,0,0]=3 18 B9R1.35 CC1=NC(C(N)=S)=CS1 W3802 [0,0,0,0,0,0|3,1,0]=4 19 B9R1.35 CC1=NN=C(C(=O)O)O1 7252AB [0,0,0,0,0,0|3,0,0]=3 20 B9R1.35 CC1=NN=C(C(=O)O)S1 6856AB [0,0,0,0,0,0|3,1,0]=4 21 B9R1.35 CC1=NNC(C(=O)O)=N1 1135AC [0,0,0,0,0,0|4,0,0]=4 22 B9R1.35 CC1=NOC(C(=O)[O-])=N1 4553AA [0,0,0,0,0,0|4,0,0]=4 23 B9R1.35 CC1=NSC(C(=O)O)=C1 7851AE [0,0,0,0,0,0|4,0,0]=4 24 B9R1.35 N=C(N)C1=CC=C(Cl)S1 6827AD [0,0,0,0,0,0|3,1,0]=4 25 B9R1.35 NC(=O)C1=CC=C(Br)O1 6684AE [0,0,0,0,0,0|2,0,0]=2 26 B9R1.35 NC(=O)C1=CN=C(N)S1 V6386 [0,0,0,0,0,0|3,1,0]=4 27 B9R1.35 NC(=O)C1=CSC(N)=N1 Z3939 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.35 NC1=CSC(C(=O)O)=C1 6089AJ [0,0,0,0,0,0|4,0,0]=4 29 B9R1.35 O=C(O)C1=CC(F)=CS1 3617AB [0,0,0,0,0,0|4,0,0]=4 30 B9R1.35 O=C(O)C1=CC(I)=CN1 2020AB [0,0,0,0,0,0|4,0,0]=4 31 B9R1.35 O=C(O)C1=CC=C(Br)N1 2776AB [0,0,0,0,0,0|3,0,0]=3 32 B9R1.35 O=C(O)C1=CC=C(F)S1 W6292 [0,0,0,0,0,0|2,1,0]=3 33 B9R1.35 O=C(O)C1=CC=C(I)O1 6244AD [0,0,0,0,0,0|2,0,0]=2 34 B9R1.35 O=C(O)C1=COC(I)=N1 4876AA [0,0,0,0,0,0|4,0,0]=4 35 B9R1.35 O=C(O)C1=NC(Br)=CO1 X6341 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.35 O=C(O)C1=NC=C(Br)S1 Y4853 [0,0,0,0,0,0|3,1,0]=4 37 B9R1.35 O=C(O)C1=NC=C(Cl)S1 Y6782 [0,0,0,0,0,0|3,1,0]=4 38 B9R1.35 O=[N+]([O-])C1=CC=C(O)S1 8009AB [0,0,0,0,0,0|3,1,0]=4 39 B8R1.1 CC1=CC=C(C#N)N1 2253AB [1,0,0,0,0,0|2,0,1]=4 40 B8R1.1 CC1=CC=C(C#N)O1 4023AD [1,0,0,0,0,0|1,0,1]=3 41 B8R1.1 CC1=CC=C(CCl)S1 4231AB [1,0,0,0,0,0|1,1,1]=4 42 B8R1.1 CC1=CC=C(CN)S1 V3761 [1,0,0,0,0,0|1,1,1]=4 43 B8R1.1 CC1=CC=C(CN)S1 Z2080 [1,0,0,0,0,0|1,1,1]=4 44 B8R1.1 CC1=CC=C(CO)S1 V7056 [1,0,0,0,0,0|0,1,2]=4 45 B8R1.1 CC1=NC=C(C=O)O1 4199AC [1,0,0,0,0,0|1,0,0]=2 46 B8R1.1 CC1=NC=C(CO)O1 8519AH [1,0,0,0,0,0|1,0,2]=4 47 B8R1.1 CC1=NOC(C=O)=C1 Y9882 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.1 CCC1=CC=C(C)O1 8739AA [1,0,0,0,0,0|0,0,1]=2 49 B8R1.1 CSC1=CC(C)=CS1 Z0195 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.1 CSC1=NC(C)=CS1 2874AJ [1,0,0,0,0,0|3,0,0]=4 51 B8R1.1 O=CC1=CC(Cl)=CS1 8472AB [1,0,0,0,0,0|3,0,0]=4 52 B8R1.1 O=CC1=CC=C(I)S1 7666AB [1,0,0,0,0,0|1,1,0]=3 53 B8R1.1 O=CC1=CNC(=O)N1 1313AC [1,0,0,0,0,0|3,0,0]=4 54 B8R1.1 O=CC1=CSC(Br)=C1 9797AA [1,0,0,0,0,0|3,0,0]=4 55 B8R1.1 O=CC1=CSC(Cl)=C1 4568AB [1,0,0,0,0,0|3,0,0]=4 56 B8R1.1 O=CC1=NC=C(Br)S1 Y5660 [1,0,0,0,0,0|2,1,0]=4 57 B8R1.1 O=CC1=NC=C(Cl)S1 Y5482 [1,0,0,0,0,0|2,1,0]=4 58 B8R1.1 OCC1=CC=C(Br)O1 Z4532 [1,0,0,0,0,0|1,0,2]=4 59 B8R1.7 C=C(C)C1=NC=CS1 5670AL [1,0,0,0,0,0|2,1,0]=4 60 B8R1.7 CC(=O)C1=CN=NS1 X9965 [1,0,0,0,0,0|2,1,0]=4 61 B8R1.7 CC(=O)C1=COC=C1 7011AA [1,0,0,0,0,0|2,0,0]=3 62 B8R1.7 CC(=O)C1=NC=NN1 4769AD [1,0,0,0,0,0|3,0,0]=4 63 B8R1.7 CC(N)C1=CC=CO1 7556AD [1,0,0,0,0,0|1,0,1]=3 64 B8R1.7 CC(O)C1=CC=CN1 Z2357 [1,0,0,0,0,0|1,0,2]=4 65 B8R1.7 NC(=O)C1=CN=CO1 Y7670 [1,0,0,0,0,0|2,0,0]=3 66 B8R1.7 NC(=O)C1=CNC=C1 1113AC [1,0,0,0,0,0|3,0,0]=4 67 B8R1.7 NC(=O)C1=CNC=N1 2439AB [1,0,0,0,0,0|3,0,0]=4 68 B8R1.7 NC(=O)C1=CSC=C1 4677AE [1,0,0,0,0,0|3,0,0]=4 69 B8R1.7 NC(=S)C1=NC=CO1 4442AJ [1,0,0,0,0,0|2,1,0]=4 70 B8R1.7 O=C(O)C1=NC=CO1 Z1844 [1,0,0,0,0,0|2,0,0]=3 71 B8R1.7 O=C(O)C1=NSC=C1 6302AB [1,0,0,0,0,0|3,0,0]=4 72 B8R1.7 O=C(O)C1C=CCO1 1916AL [1,0,0,0,0,0|1,0,2]=4 73 B8R1.7 O=C([O-])C1=NC=CS1 4281AE [1,0,0,0,0,0|2,1,0]=4 74 B10R1.14 CC1=NC(C(=O)NN)=CO1 Y5454 [0,1,0,0,0,0|3,0,0]=4 75 B10R1.14 CC1=NOC(C(=O)CBr)=C1 X8727 [0,1,0,0,0,0|3,0,0]=4 76 B10R1.14 CCC(=O)C1=CC=C(Br)S1 0221AE [0,1,0,0,0,0|1,1,0]=3 77 B10R1.14 CCC(=O)C1=CC=C(C)S1 6348AE [0,1,0,0,0,0|0,1,0]=2 78 B10R1.14 CCC(N)C1=CC=C(C)O1 9845AB [0,1,0,0,0,0|1,0,1]=3 79 B10R1.14 CC[C@@H](N)C1=CC=C(C)O1 2910AH [0,1,0,0,0,0|1,0,1]=3 80 B10R1.14 CC[C@H](N)C1=CC=C(C)O1 6453AB [0,1,0,0,0,0|1,0,1]=3 81 B10R1.14 CN1C=CC(C(=O)CCl)=C1 3400AD [0,1,0,0,0,0|2,0,0]=3 82 B10R1.14 CNC(C)C1=CC=C(C)S1 0044AD [0,1,0,0,0,0|1,1,1]=4 83 B10R1.14 COC(=O)C1=CC(Cl)=CN1 0733AD [0,1,0,0,0,0|3,0,0]=4 84 B10R1.14 COC(=O)C1=CC=C(N)O1 3572AL [0,1,0,0,0,0|1,0,0]=2 85 B10R1.14 COC(=O)C1=CN=C(Br)O1 X8907 [0,1,0,0,0,0|2,0,0]=3 86 B10R1.14 COC(=O)C1=CN=C(C)O1 Y9732 [0,1,0,0,0,0|1,0,0]=2 87 B10R1.14 COC(=O)C1=CN=C(C)S1 Y5463 [0,1,0,0,0,0|1,1,0]=3 88 B10R1.14 COC(=O)C1=CN=C(Cl)O1 Y5664 [0,1,0,0,0,0|2,0,0]=3 89 B10R1.14 COC(=O)C1=CNC(=O)N1 0686AB [0,1,0,0,0,0|3,0,0]=4 90 B10R1.31 C#CC1=CC=C(C(C)=O)S1 0109AC [0,1,0,0,0,0|0,1,1]=3 91 B10R1.31 CC(=O)C1=CC(C=O)=CS1 3015AE [0,1,0,0,0,0|2,0,1]=4 92 B10R1.31 CC(=O)C1=CC=C(C#N)O1 6108AA [0,1,0,0,0,0|0,0,1]=2 93 B10R1.31 CCC1=CC(C(=O)O)=CS1 Y1108 [0,1,0,0,0,0|3,0,0]=4 94 B10R1.31 CCC1=CC=C(C(=O)Cl)S1 9939AB [0,1,0,0,0,0|1,1,0]=3 95 B10R1.31 CCC1=CC=C(C(=O)O)O1 8236AB [0,1,0,0,0,0|1,0,0]=2 96 B10R1.31 CCC1=CC=C(C(=O)O)S1 Z2977 [0,1,0,0,0,0|1,1,0]=3 97 B10R1.31 CCC1=CSC(C(=O)O)=N1 0041AD [0,1,0,0,0,0|3,0,0]=4 98 B10R1.31 CCC1=NC(C(=O)O)=CO1 X5111 [0,1,0,0,0,0|3,0,0]=4 99 B10R1.31 CCC1=NC(C(=O)O)=CS1 1990AC [0,1,0,0,0,0|3,0,0]=4 100 B10R1.31 CN(C)C1=CC=C(C=O)O1 1748AE [0,1,0,0,0,0|2,0,1]=4 101 B10R1.31 CNC1=NC(C(=O)O)=CS1 0818AD [0,1,0,0,0,0|3,0,0]=4 102 B10R1.31 COC1=CC=C(C(=O)O)O1 3836AF [0,1,0,0,0,0|1,0,0]=2 103 B10R1.31 COC1=CN=C(C(=O)O)O1 X5064 [0,1,0,0,0,0|2,0,0]=3 104 B10R1.31 CSC1=NC(C(=O)O)=CS1 2804AF [0,1,0,0,0,0|3,0,0]=4 105 B10R1.31 N#CC1=CC=C(C(=O)O)O1 0820AB [0,1,0,0,0,0|1,0,1]=3 106 B10R1.31 N#CC1=CC=C(C(=O)O)S1 6438AE [0,1,0,0,0,0|1,1,1]=4 107 B10R1.31 NCC1=CC=C([N+](=O)[O-])S1 5247AJ [0,1,0,0,0,0|2,1,0]=4 108 B10R1.31 O=[N+]([O-])C1=CC=C(CO)S1 4775AJ [0,1,0,0,0,0|2,1,0]=4 109 B10R1.55 CC1=CC=C(S(=O)(=O)Cl)S1 V6612 [0,1,0,0,0,0|2,1,0]=4 110 B10R1.55 CC1=CC=C(S(N)(=O)=O)S1 5139AE [0,1,0,0,0,0|2,1,0]=4 111 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 2990AB [0,1,0,0,0,0|1,1,0]=3 112 B10R1.58 CC1=C(Br)SC(C(=O)O)=N1 3134AJ [0,1,0,0,0,0|3,0,0]=4 113 B10R1.58 CC1=C(C)SC(C(=O)O)=C1 5554AB [0,1,0,0,0,0|1,1,0]=3 114 B10R1.58 CC1=CC(C(N)=O)=NN1C Z2263 [0,1,0,0,0,0|3,0,0]=4 115 B10R1.58 CN1N=C(C(=O)O)C=C1Cl 9929AC [0,1,0,0,0,0|3,0,0]=4 116 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 4819AC [0,1,0,0,0,0|2,1,0]=4 117 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 4820AC [0,1,0,0,0,0|2,1,0]=4 118 B10R1.58 O=C(O)C1=CC(Br)=C(Br)N1 1031AE [0,1,0,0,0,0|3,0,0]=4 119 B10R1.59 CC(=O)C1=C(C)N=C(C)O1 7834AD [0,1,0,0,0,0|1,0,0]=2 120 B10R1.59 CC1=CN(C)N=C1C(=O)O 4727AC [0,1,0,0,0,0|3,0,0]=4 121 B10R1.59 CC1=NC(C(=O)O)=C(Br)O1 X9459 [0,1,0,0,0,0|3,0,0]=4 122 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 J11007 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.59 CN1C=C(I)C(C(=O)O)=N1 0214AC [0,1,0,0,0,0|3,0,0]=4 124 B10R1.59 CN1C=C(N)C(C(=O)O)=N1 2608AJ [0,1,0,0,0,0|3,0,0]=4 125 B10R1.59 CN1C=C(N)C(C(=O)O)=N1 2609AJ [0,1,0,0,0,0|3,0,0]=4 126 B10R1.59 O=C(O)C1=C(Cl)C=C(Br)S1 2939AC [0,1,0,0,0,0|2,1,0]=4 127 B10R1.194 CC(=O)C1=C(N)N(C)N=C1 0835AF [0,1,0,0,0,0|3,0,0]=4 128 B10R1.194 CC1=CC=C(C(=N)N)N1C 9088AE [0,1,0,0,0,0|3,0,0]=4 129 B10R1.194 CC1=CSC(C(=O)O)=C1C 4849AC [0,1,0,0,0,0|3,0,0]=4 130 B10R1.13 C=C(C)C1=CC=C(F)C=C1 2727AL [0,0,0,0,0,1|3,0,0]=4 131 B10R1.13 C=C(C)C1=CC=C(O)C=C1 5917AB [0,0,0,0,0,1|3,0,0]=4 132 B10R1.13 CC(=O)C1=CC=C(N)C=C1 6399AL [0,0,0,0,0,1|2,0,0]=3 133 B10R1.13 CC(=O)C1=CC=C(O)N=C1 X9010 [0,0,0,0,0,1|2,0,0]=3 134 B10R1.13 CC(=O)C1=CN=C(C)N=C1 4912AJ [0,0,0,0,0,1|2,0,0]=3 135 B10R1.13 CC(=O)C1=CN=C(N)C=C1 0193AB [0,0,0,0,0,1|2,0,0]=3 136 B10R1.13 CC(=O)C1=NC=C(C)N=C1 9503AH [0,0,0,0,0,1|2,0,0]=3 137 B10R1.13 CC(=O)C1=NN=C(Cl)C=C1 0919AB [0,0,0,0,0,1|2,0,0]=3 138 B10R1.13 CC(=O)C1CC=C(C)CC1 Z4935 [0,0,0,0,0,1|1,0,2]=4 139 B10R1.13 CC1=CC=C(C(=O)[O-])C=C1 8386AA [0,0,0,0,0,1|2,0,0]=3 140 B10R1.13 CC1=CC=C(C(C)N)N=C1 4578AH [0,0,0,0,0,1|2,0,1]=4 141 B10R1.13 CC1=CC=C(C(C)N)N=C1 9504AH [0,0,0,0,0,1|2,0,1]=4 142 B10R1.13 CC1=CC=C([C@@H](C)N)C=C1 O143 [0,0,0,0,0,1|2,0,1]=4 143 B10R1.13 CC1=CC=C([C@H](C)N)C=C1 2564AB [0,0,0,0,0,1|2,0,1]=4 144 B10R1.13 CC1=CN=C(C(=O)O)N=C1 Z5426 [0,0,0,0,0,1|3,0,0]=4 145 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 5861AC [0,0,0,0,0,1|3,0,0]=4 146 B10R1.13 NC(=O)C1=CN=C(N)C=C1 Z2495 [0,0,0,0,0,1|3,0,0]=4 147 B10R1.13 NC(=O)C1=CN=C(O)C=C1 U983 [0,0,0,0,0,1|3,0,0]=4 148 B10R1.13 NC(=O)C1=NN=C(O)C=C1 6449AJ [0,0,0,0,0,1|3,0,0]=4 149 B10R1.13 NC1=CC=C(C(=O)O)C=N1 3422AJ [0,0,0,0,0,1|3,0,0]=4 150 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 7848AF [0,0,0,0,0,1|3,0,0]=4 151 B10R1.13 O=C(O)C1=CC=C(Br)N=N1 9979AB [0,0,0,0,0,1|3,0,0]=4 152 B10R1.13 O=C([O-])C1=NN=C(Cl)C=C1 Y4602 [0,0,0,0,0,1|3,0,0]=4 153 B10R1.54 CC(=O)NC1=NC(C)=CS1 W8155 [0,0,0,0,0,1|2,0,0]=3 154 B10R1.54 CC(=O)NC1=NC=C(Cl)S1 0584AQ [0,0,0,0,0,1|2,1,0]=4 155 B10R1.54 CC(=O)NC1=NNC(C)=C1 W8674 [0,0,0,0,0,1|3,0,0]=4 156 B10R1.54 CC1=CC=C(CC(=O)O)S1 0941AC [0,0,0,0,0,1|1,1,0]=3 157 B10R1.54 CC1=CSC(CC(N)=O)=N1 5602AD [0,0,0,0,0,1|3,0,0]=4 158 B10R1.54 CC1=NC(CC(N)=O)=CS1 6231AD [0,0,0,0,0,1|3,0,0]=4 159 B10R1.54 CC1=NN(CC(=O)O)C=C1 9479AA [0,0,0,0,0,1|3,0,0]=4 160 B10R1.54 CC1=NN=C(CC(=O)O)O1 8853AH [0,0,0,0,0,1|3,0,0]=4 161 B10R1.113 C=C(C)C1=CN=CC(Br)=C1 W6093 [0,0,0,0,0,1|3,0,0]=4 162 B10R1.113 CC(=O)C1=CC(Br)=NC=C1 3551AC [0,0,0,0,0,1|2,0,0]=3 163 B10R1.113 CC(=O)C1=CC(F)=CN=C1 3535AA [0,0,0,0,0,1|2,0,0]=3 164 B10R1.113 CC(=O)C1=CC(F)=CN=C1 4092AB [0,0,0,0,0,1|2,0,0]=3 165 B10R1.113 CC(=O)C1=NC(C)=NC=C1 0456AC [0,0,0,0,0,1|1,0,0]=2 166 B10R1.113 CC(=O)C1=NC(N)=NC=C1 8301AC [0,0,0,0,0,1|2,0,0]=3 167 B10R1.113 CC1=CC(C(=O)O)=NC=N1 6686AA [0,0,0,0,0,1|3,0,0]=4 168 B10R1.113 CC1=CC(C(C)N)=NC=C1 5999AE [0,0,0,0,0,1|2,0,1]=4 169 B10R1.113 CC1=CC(C(N)=O)=NC=C1 5258AE [0,0,0,0,0,1|2,0,0]=3 170 B10R1.113 CC1=CC(C(N)=S)=NC=C1 5196AD [0,0,0,0,0,1|2,1,0]=4 171 B10R1.113 CC1=CC(N(C)C)=NC=C1 0347AB [0,0,0,0,0,1|3,0,0]=4 172 B10R1.113 CC1=CC(N(C)N)=CC=C1 4897AL [0,0,0,0,0,1|3,0,0]=4 173 B10R1.113 CC1=CC=CC(C(C)C)=C1 5135AE [0,0,0,0,0,1|2,0,1]=4 174 B10R1.113 CC1=CC=CC(C(C)O)=C1 8099AF [0,0,0,0,0,1|1,0,2]=4 175 B10R1.113 CC1=NC(C(C)N)=CC=C1 9513AH [0,0,0,0,0,1|2,0,1]=4 176 B10R1.113 CC1=NC(C(N)=O)=NC=C1 6042AA [0,0,0,0,0,1|2,0,0]=3 177 B10R1.113 C[N+]1=CC(C(N)=O)=CC=C1 6013AL [0,0,0,0,0,1|3,0,0]=4 178 B10R1.113 NC(=O)C1=CN=CC(F)=C1 V7403 [0,0,0,0,0,1|3,0,0]=4 179 B10R1.113 NC(=O)C1=NC(N)=CC=C1 3423AJ [0,0,0,0,0,1|3,0,0]=4 180 B10R1.113 NC1=CC(C(=O)[O-])=CC=C1 5988AL [0,0,0,0,0,1|3,0,0]=4 181 B10R1.113 NC1=NC=CC(C(=O)O)=N1 W4491 [0,0,0,0,0,1|3,0,0]=4 182 B10R1.113 O=C(Cl)C1=CC(Cl)=CC=C1 J70037 [0,0,0,0,0,1|3,0,0]=4 183 B10R1.113 O=C(Cl)C1=CC(F)=NC=C1 Z2563 [0,0,0,0,0,1|3,0,0]=4 184 B10R1.113 O=C(O)C1=NC(I)=CC=C1 5470AE [0,0,0,0,0,1|3,0,0]=4 185 B10R1.113 O=C(O)C1=NC=CC(F)=C1 W9141 [0,0,0,0,0,1|3,0,0]=4 186 B10R1.113 O=C([O-])C1=NC=CC(I)=C1 6772AE [0,0,0,0,0,1|3,0,0]=4 187 B7R1.1 CCC1=CC=NO1 3273AB [2,0,0,0,0,0|1,0,1]=4 188 B7R1.1 COC1=CC=CO1 2109AL [2,0,0,0,0,0|1,0,0]=3 189 B7R1.1 CSC1=NC=CO1 6777AD [2,0,0,0,0,0|2,0,0]=4 190 B7R1.1 O=CC1=CC=C[Se]1 5634AL [2,0,0,0,0,0|0,1,0]=3 191 B7R1.1 O=CC1=CC=NS1 7399AB [2,0,0,0,0,0|1,1,0]=4 192 B7R1.1 O=CC1=CN=CO1 X9341 [2,0,0,0,0,0|1,0,0]=3 193 B7R1.1 O=CC1=NC=CO1 7478AE [2,0,0,0,0,0|1,0,0]=3 194 B7R1.1 O=CC1=NOC=C1 4723AC [2,0,0,0,0,0|2,0,0]=4 195 B7R1.2 BrC1=CC=C(Br)O1 Z5509 [2,0,0,0,0,0|2,0,0]=4 196 B7R1.2 CC1=CC=C(Cl)S1 8881AA [2,0,0,0,0,0|1,1,0]=4 197 B7R1.2 CC1=CC=C(N)S1 5777AB [2,0,0,0,0,0|1,1,0]=4 198 B7R1.2 CC1=CN=C(N)O1 X6056 [2,0,0,0,0,0|2,0,0]=4 199 B7R1.2 CC1=COC(C)=N1 5323AL [2,0,0,0,0,0|2,0,0]=4 200 B7R1.2 CC1=NN=C(C)O1 Z4081 [2,0,0,0,0,0|2,0,0]=4 201 B7R1.2 O=C1C=CC(O)O1 2926AL [2,0,0,0,0,0|1,0,1]=4 202 B9R1.7 CC1=CC=C(CCN)S1 5238AJ [1,1,0,0,0,0|0,1,1]=4 203 B9R1.7 CC1=CC=C(CCN)S1 9610AD [1,1,0,0,0,0|0,1,1]=4 204 B9R1.7 CNCC1=CC=C(Br)O1 2148AF [1,1,0,0,0,0|1,0,1]=4 205 B9R1.7 CNCC1=CC=C(C)S1 5250AC [1,1,0,0,0,0|0,1,1]=4 206 B9R1.21 C#CC1=CC=C(C=O)S1 0597AB [1,1,0,0,0,0|0,1,1]=4 207 B9R1.21 CCC1=CC=C(CC)O1 Z5436 [1,1,0,0,0,0|0,0,1]=3 208 B9R1.21 CCC1=CSC(C=O)=N1 0809AB [1,1,0,0,0,0|2,0,0]=4 209 B9R1.21 CCC1=NC=C(C=O)S1 5803AC [1,1,0,0,0,0|1,1,0]=4 210 B9R1.21 COC1=CC=C(C=O)S1 4303AB [1,1,0,0,0,0|0,1,0]=3 211 B9R1.21 COC1=NC=C(C=O)S1 W9748 [1,1,0,0,0,0|1,1,0]=4 212 B9R1.21 CSC1=CC=C(C=O)S1 Z2926 [1,1,0,0,0,0|0,1,0]=3 213 B9R1.21 N#CC1=CC=C(C=O)O1 5795AB [1,1,0,0,0,0|0,0,1]=3 214 B9R1.21 N#CC1=CC=C(CN)O1 2978AJ [1,1,0,0,0,0|1,0,1]=4 215 B9R1.21 O=CC1=CC=C(CCl)O1 Y6574 [1,1,0,0,0,0|0,0,0]=2 216 B9R1.21 O=CC1=CC=C(CO)N1 0366AC [1,1,0,0,0,0|1,0,0]=3 217 B9R1.22 CC1=NC(C)=C(C=O)O1 0653AC [1,1,0,0,0,0|1,0,0]=3 218 B9R1.22 CC1=NC(C=O)=C(C)N1 0528AC [1,1,0,0,0,0|2,0,0]=4 219 B9R1.23 CC1=C(Br)SC(C=O)=N1 4318AF [1,1,0,0,0,0|2,0,0]=4 220 B9R1.23 CC1=C(C)NC(C=O)=N1 Y3244 [1,1,0,0,0,0|2,0,0]=4 221 B9R1.23 CC1=C(C)OC(C=O)=C1 Y9335 [1,1,0,0,0,0|0,0,0]=2 222 B9R1.23 CC1=C(C)SC(C=O)=C1 0832AQ [1,1,0,0,0,0|0,1,0]=3 223 B9R1.23 CC1=CC(C=O)=NN1C Y8435 [1,1,0,0,0,0|2,0,0]=4 224 B9R1.23 O=CC1=CC(Br)=C(Br)O1 D393 [1,1,0,0,0,0|1,0,0]=3 225 B9R1.132 CC1=CNC(C=O)=C1C 6636AD [1,1,0,0,0,0|2,0,0]=4 226 B9R1.132 CC1=NC=C(C=O)N1C Y8403 [1,1,0,0,0,0|2,0,0]=4 227 B9R1.11 COC(=O)C1=CC=NS1 4171AJ [1,1,0,0,0,0|1,1,0]=4 228 B9R1.11 COC(=O)C1=CN=CO1 Y7252 [1,1,0,0,0,0|1,0,0]=3 229 B9R1.11 COC(=O)C1=COC=N1 8746AA [1,1,0,0,0,0|2,0,0]=4 230 B9R1.11 CSC(=O)C1=CSC=N1 V9051 [1,1,0,0,0,0|2,0,0]=4 231 B9R1.11 N#CC(=O)C1=CC=CO1 9015AB [1,1,0,0,0,0|0,0,1]=3 232 B9R1.11 N#CC(=O)C1=CC=CS1 6481AE [1,1,0,0,0,0|0,1,1]=4 233 B9R1.11 NCC(O)C1=CC=CO1 8969AD [1,1,0,0,0,0|0,0,2]=4 234 B9R1.11 N\C(=N/O)C1=CC=CO1 2252AB [1,1,0,0,0,0|1,0,1]=4 235 B9R1.11 O=C(CBr)C1=CC=CO1 Y7600 [1,1,0,0,0,0|0,0,0]=2 236 B9R1.11 O=C(CBr)C1=CSC=N1 3999AJ [1,1,0,0,0,0|2,0,0]=4 237 B9R1.11 O=C(CBr)C1=NC=CS1 6733AD [1,1,0,0,0,0|1,1,0]=4 238 B9R1.11 O=C(CCl)C1=NC=CO1 1641AJ [1,1,0,0,0,0|1,0,0]=3 239 B9R1.11 O=CC(=O)C1=CC=CO1 8783AA [1,1,0,0,0,0|0,0,1]=3 240 B9R1.11 O=CC(=O)C1=CC=CS1 W3018 [1,1,0,0,0,0|0,1,1]=4 241 B9R1.11 OC[C@@H](O)C1=CC=CO1 1030AL [1,1,0,0,0,0|0,0,2]=4 242 B9R1.19 CS(=O)(=O)C1=CC=CN1 V7881 [1,1,0,0,0,0|2,0,0]=4 243 B9R1.19 O=S(=O)(Cl)C1=CC=CO1 Y9339 [1,1,0,0,0,0|2,0,0]=4 244 B9R1.41 CC(=O)C1=C(C)C=CS1 Z5455 [1,1,0,0,0,0|0,1,0]=3 245 B9R1.41 CC(=O)C1=C(C)N=CS1 4928AB [1,1,0,0,0,0|1,1,0]=4 246 B9R1.41 CC(=O)C1=C(N)C=CS1 3514AB [1,1,0,0,0,0|0,1,0]=3 247 B9R1.41 CC(=O)N1C=CC=C1Br 5036AJ [1,1,0,0,0,0|2,0,0]=4 248 B9R1.41 CC1=C(C(=O)Cl)OC=N1 Y9645 [1,1,0,0,0,0|2,0,0]=4 249 B9R1.41 O=C(O)C1=C(Br)C=CO1 Z5464 [1,1,0,0,0,0|1,0,0]=3 250 B11R1.3 C#CC1=CC=C(C(C)=O)C=C1 5858AB [0,1,0,0,0,1|1,0,1]=4 251 B11R1.3 C=C(C)C1=CC=C(OC)C=C1 5524AD [0,1,0,0,0,1|2,0,0]=4 252 B11R1.3 CC(=O)C1=CC=C(C=O)C=C1 X2027 [0,1,0,0,0,1|1,0,1]=4 253 B11R1.3 CCC1=CC=C(C(=O)O)N=C1 2011AC [0,1,0,0,0,1|2,0,0]=4 254 B11R1.3 CNC1=NC=C(C(=O)O)C=C1 2293AB [0,1,0,0,0,1|2,0,0]=4 255 B11R1.3 COC1=CN=C(C(C)=O)C=C1 V5184 [0,1,0,0,0,1|1,0,0]=3 256 B11R1.3 COC1=CN=C(C(N)=O)C=C1 V8588 [0,1,0,0,0,1|2,0,0]=4 257 B11R1.3 COC1=NC=C(C(N)=O)C=C1 V7449 [0,1,0,0,0,1|2,0,0]=4 258 B11R1.3 CSC1=CC=C(C(=O)Cl)C=C1 0486AQ [0,1,0,0,0,1|2,0,0]=4 259 B11R1.3 O=C(Br)C1=CC=C(CBr)C=C1 Z2833 [0,1,0,0,0,1|2,0,0]=4 260 B11R1.3 O=C(O)C1=CC=C(CO)N=C1 2161AC [0,1,0,0,0,1|2,0,0]=4 261 B11R1.21 CC(=O)C1=CC(Cl)=C(Cl)N=C1 1001AD [0,1,0,0,0,1|2,0,0]=4 262 B11R1.21 CC(=O)C1=CC(N)=C(C)C=C1 8759AA [0,1,0,0,0,1|1,0,0]=3 263 B11R1.21 CC(=O)C1=CN=C(C)C(C)=N1 7817AB [0,1,0,0,0,1|2,0,0]=4 264 B11R1.21 CC1=CC=C(C(=O)O)N=C1C 2856AC [0,1,0,0,0,1|2,0,0]=4 265 B11R1.21 CC1=CC=C(C(=O)O)NC1=O 2494AA [0,1,0,0,0,1|2,0,0]=4 266 B11R1.22 CC1=CC=C(C(=O)CCl)C=C1 P247 [0,1,0,0,0,1|1,0,0]=3 267 B11R1.22 CC1=CC=C(N(C)C=O)C=C1 8372AL [0,1,0,0,0,1|2,0,0]=4 268 B11R1.22 COC(=O)C1=CN=C(C)N=C1 5600AE [0,1,0,0,0,1|2,0,0]=4 269 B11R1.22 COC(=O)C1=NN=C(N)C=C1 V9902 [0,1,0,0,0,1|2,0,0]=4 270 B11R1.22 NC1=CC=C(C(=O)CBr)C=C1 2630AL [0,1,0,0,0,1|2,0,0]=4 271 B11R1.22 NCC(=O)C1=CC=C(I)C=C1 9286AB [0,1,0,0,0,1|2,0,0]=4 272 B11R1.22 O=C(CBr)C1=CC=C(Br)N=C1 Y6042 [0,1,0,0,0,1|2,0,0]=4 273 B11R1.22 O=C(CBr)C1=NC=C(Cl)C=C1 Y4820 [0,1,0,0,0,1|2,0,0]=4 274 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 5935AC [0,1,0,0,0,1|2,0,0]=4 275 B11R1.22 O=C(CCl)C1=CC=C(O)C=C1 9573AB [0,1,0,0,0,1|2,0,0]=4 276 B11R1.22 O=C(CF)C1=CC=C(Cl)C=C1 Y8738 [0,1,0,0,0,1|2,0,0]=4 277 B11R1.22 O=C(CO)C1=CC=C(I)C=C1 2338AC [0,1,0,0,0,1|2,0,0]=4 278 B11R1.166 CC(=O)C1=C(Br)C=C(C)C=C1 1378AL [0,1,0,0,0,1|1,0,0]=3 279 B11R1.166 CC(=O)C1=C(C)C=C(Cl)C=C1 5596AH [0,1,0,0,0,1|2,0,0]=4 280 B11R1.166 CC(=O)C1=C(C)NC(=O)C=C1 4868AE [0,1,0,0,0,1|2,0,0]=4 281 B11R1.166 CC(=O)C1=CC=C(I)C=C1O 5230AB [0,1,0,0,0,1|2,0,0]=4 282 B11R1.166 CC(=O)C1=CC=C(N)C=C1C 4920AB [0,1,0,0,0,1|2,0,0]=4 283 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 2069AF [0,1,0,0,0,1|2,0,0]=4 284 B11R1.166 CC(=O)C1=NC=C(Br)C=C1F Z7758 [0,1,0,0,0,1|2,0,0]=4 285 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 Y8311 [0,1,0,0,0,1|2,0,0]=4 286 B11R1.166 CC1=CC(F)=C(C(=O)O)C=N1 1357AA [0,1,0,0,0,1|2,0,0]=4 287 B11R1.166 CC1=CC=C(C(=O)O)C(Br)=N1 1620AJ [0,1,0,0,0,1|2,0,0]=4 288 B11R1.166 CC1=CC=C(C(=O)O)C(I)=C1 2096AL [0,1,0,0,0,1|2,0,0]=4 289 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 Y9176 [0,1,0,0,0,1|2,0,0]=4 290 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 2277AJ [0,1,0,0,0,1|2,0,0]=4 291 B11R1.166 CC1=NC=C(C(=O)O)C(N)=C1 X9715 [0,1,0,0,0,1|2,0,0]=4 292 B11R1.39 CN1C=CC(NC(=O)CCl)=N1 4458AF [0,1,0,0,0,1|2,0,0]=4 293 B11R1.39 COC(=O)CC1=NC(C)=CS1 Z7857 [0,1,0,0,0,1|2,0,0]=4 294 B11R1.43 CC(=O)NC1=NC(CCl)=CS1 Y9990 [0,1,0,0,0,1|2,0,0]=4 295 B11R1.314 CC1=CC=C(C(N)C(=O)O)S1 4881AC [0,1,0,0,0,1|1,1,0]=4 296 B11R1.23 CC1=CC(C(=O)CN)=CC=C1 0979AC [0,1,0,0,0,1|1,0,0]=3 297 B11R1.23 CC1=CC=CC(C(=O)C#N)=C1 5362AH [0,1,0,0,0,1|1,0,1]=4 298 B11R1.23 CNC(=O)C1=NC(Br)=CC=C1 V5271 [0,1,0,0,0,1|2,0,0]=4 299 B11R1.23 CNC(=O)C1=NC=CC(Br)=C1 0213AP [0,1,0,0,0,1|2,0,0]=4 300 B11R1.23 COC(=O)C1=CC=CC(S)=C1 8846AE [0,1,0,0,0,1|2,0,0]=4 301 B11R1.23 COC(=O)C1=NC(C)=CN=C1 7130AJ [0,1,0,0,0,1|1,0,0]=3 302 B11R1.23 COC(=O)C1=NC(I)=CC=C1 0627AF [0,1,0,0,0,1|2,0,0]=4 303 B11R1.23 COC(=O)C1=NC(N)=CC=N1 1094AC [0,1,0,0,0,1|2,0,0]=4 304 B11R1.23 NCC(=O)C1=CC(F)=CC=C1 5755AC [0,1,0,0,0,1|2,0,0]=4 305 B11R1.23 NCC(=O)C1=CC=CC(Cl)=C1 V2280 [0,1,0,0,0,1|2,0,0]=4 306 B11R1.23 O=C(CBr)C1=CC(Cl)=NC=C1 5465AJ [0,1,0,0,0,1|2,0,0]=4 307 B11R1.23 O=C(CCl)C1=CC=CC(F)=C1 7664AB [0,1,0,0,0,1|2,0,0]=4 308 B11R1.74 CC(=O)C1=CC(C)=CC(C)=N1 8866AB [0,1,0,0,0,1|1,0,0]=3 309 B11R1.74 CC(=O)C1=CC(C)=NC(C)=C1 1375AL [0,1,0,0,0,1|1,0,0]=3 310 B11R1.74 CC1=CC(=O)C=C(C(=O)O)N1 4279AD [0,1,0,0,0,1|2,0,0]=4 311 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=N1 4513AC [0,1,0,0,0,1|2,0,0]=4 312 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 3341AC [0,1,0,0,0,1|2,0,0]=4 313 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=N1 3141AB [0,1,0,0,0,1|2,0,0]=4 314 B11R1.155 CC1=NC(S(C)(=O)=O)=NC=C1 Z2412 [0,1,0,0,0,1|2,0,0]=4 315 B11R1.159 CC(=O)C1=C(N)C(Br)=CC=C1 Q602 [0,1,0,0,0,1|2,0,0]=4 316 B11R1.159 CC(=O)C1=CC=CC(O)=C1O X9891 [0,1,0,0,0,1|2,0,0]=4 317 B11R1.159 CC1=C(O)C(C(N)=O)=CC=C1 5564AJ [0,1,0,0,0,1|2,0,0]=4 318 B11R1.167 CC(=O)C1=C(Br)C=CC(C)=C1 X7080 [0,1,0,0,0,1|1,0,0]=3 319 B11R1.167 CC(=O)C1=CC(C)=CN=C1Cl 1794AF [0,1,0,0,0,1|1,0,0]=3 320 B11R1.167 CC(=O)C1=CC(N)=CC=C1F X8360 [0,1,0,0,0,1|2,0,0]=4 321 B11R1.167 CC1=C(C(=O)O)OC(=O)C=C1 3225AB [0,1,0,0,0,1|2,0,0]=4 322 B11R1.167 CC1=CN=C(F)C(C(=O)O)=C1 Y3581 [0,1,0,0,0,1|2,0,0]=4 323 B11R1.167 CC1=NC(C(=O)O)=C(C)C=C1 2855AC [0,1,0,0,0,1|2,0,0]=4 324 B11R1.167 CC1=NC(C(=O)O)=C(O)C=C1 6892AA [0,1,0,0,0,1|2,0,0]=4 325 B11R1.167 CC1=NC=C(Cl)C(C(=O)O)=N1 1633AC [0,1,0,0,0,1|2,0,0]=4 326 B11R1.167 CC1=NC=C(N)C(C(=O)O)=C1 4148AC [0,1,0,0,0,1|2,0,0]=4 327 B11R1.266 C#CC1=CC(C(C)=O)=CC=C1 6794AA [0,1,0,0,0,1|1,0,1]=4 328 B11R1.266 CCC1=CC(C(C)=O)=CC=C1 1395AB [0,1,0,0,0,1|1,0,0]=3 329 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 Z4715 [0,1,0,0,0,1|2,0,0]=4 330 B11R1.266 CCC1=CC=CC(C(N)=O)=N1 2254AC [0,1,0,0,0,1|2,0,0]=4 331 B11R1.266 CCC1=NC(C(=O)O)=CC=C1 6504AB [0,1,0,0,0,1|2,0,0]=4 332 B11R1.266 CCC1=NC=CC(C(=O)O)=C1 0646AE [0,1,0,0,0,1|2,0,0]=4 333 B11R1.266 CNC1=CN=CC(C(=O)O)=C1 6280AJ [0,1,0,0,0,1|2,0,0]=4 334 B11R1.266 CNC1=NC=CC(C(=O)O)=C1 3929AC [0,1,0,0,0,1|2,0,0]=4 335 B11R1.266 COC1=CC(C(C)=O)=NC=C1 8865AB [0,1,0,0,0,1|1,0,0]=3 336 B11R1.266 COC1=CN=CC(C(C)=O)=C1 X7999 [0,1,0,0,0,1|1,0,0]=3 337 B11R1.266 CSC1=CC(C(=O)O)=CN=C1 Z0823 [0,1,0,0,0,1|2,0,0]=4 338 B11R1.266 NC(=O)C1=CC=CC(CCl)=C1 6370AA [0,1,0,0,0,1|2,0,0]=4 339 B11R1.266 O=C(Br)C1=CC=CC(CBr)=C1 7128AD [0,1,0,0,0,1|2,0,0]=4 340 B11R1.266 O=C(O)C1=CC(CO)=NC=C1 Y9548 [0,1,0,0,0,1|2,0,0]=4 341 B11R1.15 CCCC(=O)C1=CC=C(Br)S1 8324AC [0,2,0,0,0,0|1,1,0]=4 342 B11R1.15 CCCC(=O)C1=CC=C(C)S1 9890AE [0,2,0,0,0,0|0,1,0]=3 343 B11R1.15 CCCC(=O)C1=CC=C(Cl)S1 W5424 [0,2,0,0,0,0|1,1,0]=4 344 B11R1.15 CCNC(=O)C1=CC=C(Br)S1 2837AF [0,2,0,0,0,0|1,1,0]=4 345 B11R1.15 CCOC(=O)C1=CC(C)=CN1 J92712 [0,2,0,0,0,0|2,0,0]=4 346 B11R1.15 CCOC(=O)C1=CC(C)=CN1 X6062 [0,2,0,0,0,0|2,0,0]=4 347 B11R1.15 CCOC(=O)C1=CNC(=O)O1 Z7610 [0,2,0,0,0,0|2,0,0]=4 348 B11R1.15 CCOC(=O)C1=NC(C)=CO1 5141AC [0,2,0,0,0,0|2,0,0]=4 349 B11R1.15 CCOC(=O)C1=NC=C(C)O1 3789AB [0,2,0,0,0,0|1,0,0]=3 350 B11R1.15 CCOC(=O)C1=NC=C(C)S1 8637AB [0,2,0,0,0,0|1,1,0]=4 351 B11R1.15 N#CCC(=O)C1=CC=C(Br)S1 X0196 [0,2,0,0,0,0|1,1,0]=4 352 B11R1.15 N#CCC(=O)C1=CC=C(Cl)S1 X0197 [0,2,0,0,0,0|1,1,0]=4 353 B11R1.44 CCC1=CC=C(C(=O)NN)S1 7943AE [0,2,0,0,0,0|1,1,0]=4 354 B11R1.44 CNC(=O)C1=CSC(NC)=N1 V2599 [0,2,0,0,0,0|2,0,0]=4 355 B11R1.44 COC(=O)C1=CC(CCl)=CS1 4227AB [0,2,0,0,0,0|2,0,0]=4 356 B11R1.44 COC(=O)C1=CC(CO)=CS1 2656AC [0,2,0,0,0,0|2,0,0]=4 357 B11R1.44 COC(=O)C1=CC=C(CBr)S1 8495AC [0,2,0,0,0,0|0,1,0]=3 358 B11R1.44 COC(=O)C1=CC=C(CN)N1 2327AB [0,2,0,0,0,0|1,0,0]=3 359 B11R1.44 COC(=O)C1=CC=C(CO)O1 1747AE [0,2,0,0,0,0|0,0,0]=2 360 B11R1.225 CC1=CC(C(=O)CCl)=C(C)N1 1634AJ [0,2,0,0,0,0|2,0,0]=4 361 B11R1.225 CC1=CC(C(=O)CCl)=C(C)S1 0051AE [0,2,0,0,0,0|2,0,0]=4 362 B11R1.225 CC1=CC(C)=NN1C(=O)CCl 1622AE [0,2,0,0,0,0|2,0,0]=4 363 B11R1.225 CC1=NC(C)=C(C(=O)NN)O1 2365AF [0,2,0,0,0,0|2,0,0]=4 364 B11R1.225 COC(=O)C1=C(Br)SC(C)=C1 Y4795 [0,2,0,0,0,0|2,0,0]=4 365 B11R1.225 COC(=O)C1=C(C)C=C(Br)S1 7112AJ [0,2,0,0,0,0|1,1,0]=4 366 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 0774AC [0,2,0,0,0,0|2,0,0]=4 367 B11R1.225 COC(=O)C1=C(F)C=C(Br)S1 0105AP [0,2,0,0,0,0|1,1,0]=4 368 B11R1.225 COC(=O)C1=C(N)C=C(C)N1 4801AA [0,2,0,0,0,0|1,0,0]=3 369 B11R1.225 COC(=O)C1=C(O)C=C(Cl)S1 6409AC [0,2,0,0,0,0|1,1,0]=4 370 B11R1.226 CCC(=O)C1=CC(Br)=C(C)S1 V8713 [0,2,0,0,0,0|0,1,0]=3 371 B11R1.226 COC(=O)C1=CC(Br)=C(Br)N1 V9305 [0,2,0,0,0,0|2,0,0]=4 372 B11R1.226 COC(=O)C1=CC(Br)=C(Br)S1 Y6332 [0,2,0,0,0,0|1,1,0]=4 373 B11R1.226 COC(=O)C1=CC(Br)=C(C)S1 1637AB [0,2,0,0,0,0|0,1,0]=3 374 B11R1.48 CC(=O)C1=CC(C#N)=C(C)O1 6982AB [0,2,0,0,0,0|0,0,0]=2 375 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 2729AE [0,2,0,0,0,0|1,1,0]=4 376 B11R1.50 CCC1=NC(C)=C(C(=O)O)O1 X6011 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.124 CC(=O)C1=CC=C(CC#N)S1 8424AC [0,2,0,0,0,0|0,1,0]=3 378 B11R1.124 CCCC1=CC=C(C(=O)O)S1 7046AE [0,2,0,0,0,0|1,1,0]=4 379 B11R1.124 CCOC1=CC=C(C(=O)O)O1 9541AC [0,2,0,0,0,0|1,0,0]=3 380 B11R1.124 CCOC1=CC=C(C(=O)O)S1 6357AJ [0,2,0,0,0,0|1,1,0]=4 381 B11R1.49 COC1=C(C(=O)O)SC(C)=C1 2845AC [0,2,0,0,0,0|1,1,0]=4 382 B9R1.69 CC1=CC(C)=NC=C1O 8941AD [0,0,1,1,0,0|2,0,0]=4 383 B9R1.69 CC1=CC=C(O)C(Cl)=N1 V5467 [0,0,1,1,0,0|2,0,0]=4 384 B9R1.69 CC1=CC=C(O)C(F)=N1 N386 [0,0,1,1,0,0|2,0,0]=4 385 B9R1.69 CC1=CC=C(O)C(N)=N1 W4287 [0,0,1,1,0,0|2,0,0]=4 386 B9R1.69 CC1=CN=C(O)C(C)=N1 W7279 [0,0,1,1,0,0|2,0,0]=4 387 B9R1.69 CC1=NC(F)=CC=C1O Y3898 [0,0,1,1,0,0|2,0,0]=4 388 B7R1.18 CC(=O)N1C=CC1 6529AA [1,0,0,0,1,0|1,0,1]=4 389 B9R1.2 C=CC1=CC(C)=CC=C1 6123AL [1,0,0,0,0,1|1,0,1]=4 390 B9R1.2 C=CC1=CC(C)=CC=N1 6788AA [1,0,0,0,0,1|1,0,1]=4 391 B9R1.2 CC1=CN=CC(C=O)=N1 2745AA [1,0,0,0,0,1|1,0,0]=3 392 B9R1.2 CC1=NC=CC(C=O)=C1 9828AC [1,0,0,0,0,1|1,0,0]=3 393 B9R1.2 CC1=NC=CC(C=O)=N1 X8509 [1,0,0,0,0,1|1,0,0]=3 394 B9R1.2 CCC1=NC(C)=CC=C1 2156AA [1,0,0,0,0,1|1,0,1]=4 395 B9R1.2 CNC1=NC=CC(C)=N1 Z2893 [1,0,0,0,0,1|2,0,0]=4 396 B9R1.2 COC1=CC(C)=CN=C1 2251AC [1,0,0,0,0,1|2,0,0]=4 397 B9R1.2 COC1=NC(C)=CN=C1 2865AB [1,0,0,0,0,1|2,0,0]=4 398 B9R1.2 CSC1=NC(C)=CN=C1 2879AB [1,0,0,0,0,1|2,0,0]=4 399 B9R1.2 NC1=CC(C=O)=CC=C1 Y7351 [1,0,0,0,0,1|2,0,0]=4 400 B9R1.2 NC1=CC=CC(C=O)=C1 X3987 [1,0,0,0,0,1|2,0,0]=4 401 B9R1.2 NC1=CC=CC(C=O)=N1 3868AB [1,0,0,0,0,1|2,0,0]=4 402 B9R1.2 O=CC1=CC(F)=NC=C1 X9807 [1,0,0,0,0,1|2,0,0]=4 403 B9R1.2 O=CC1=CC(I)=CN=C1 1479AF [1,0,0,0,0,1|2,0,0]=4 404 B9R1.2 O=CC1=CC=CC(F)=N1 N399 [1,0,0,0,0,1|2,0,0]=4 405 B9R1.2 O=CC1=CN=CC(Cl)=C1 W9911 [1,0,0,0,0,1|2,0,0]=4 406 B9R1.2 O=CC1=NC(Cl)=CN=C1 3835AC [1,0,0,0,0,1|2,0,0]=4 407 B9R1.2 O=CC1=NC=CC(O)=C1 1364AA [1,0,0,0,0,1|2,0,0]=4 408 B9R1.13 CC(=O)CC1=CC=CS1 4644AD [1,0,0,0,0,1|0,1,0]=3 409 B9R1.13 CC(=O)CC1=CSC=C1 1470AL [1,0,0,0,0,1|2,0,0]=4 410 B9R1.13 CC(=O)NC1=CC=CS1 D141 [1,0,0,0,0,1|0,1,0]=3 411 B9R1.13 CC(N)CC1=CC=CO1 8493AB [1,0,0,0,0,1|1,0,1]=4 412 B9R1.13 CC(O)CC1=CC=CO1 6519AJ [1,0,0,0,0,1|0,0,2]=4 413 B9R1.13 O=C(O)CC1=CC=CN1 2447AC [1,0,0,0,0,1|2,0,0]=4 414 B11R1.20 CC(=O)NC1=CN=C(Cl)C=C1 V5002 [0,0,0,0,0,2|2,0,0]=4 415 B11R1.20 CC(=O)NC1=NC=C(C)C=C1 Y9207 [0,0,0,0,0,2|1,0,0]=3 416 B11R1.20 CC(=O)NC1=NC=C(F)C=C1 N473 [0,0,0,0,0,2|2,0,0]=4 417 B11R1.20 CC1=CC=C(CC(=O)O)C=N1 V4105 [0,0,0,0,0,2|2,0,0]=4 418 B11R1.75 CC1=CC=C(CCC(=O)O)S1 2246AL [0,0,0,0,0,2|1,1,0]=4 419 B11R1.75 CC1=CC=C(CNC(C)C)O1 0886AF [0,0,0,0,0,2|1,0,1]=4 420 B11R1.157 CC(=O)CC1=NC(C)=CC=C1 9512AH [0,0,0,0,0,2|1,0,0]=3 421 B11R1.157 CC(=O)NC1=CC=CC(Cl)=C1 8054AF [0,0,0,0,0,2|2,0,0]=4 422 B11R1.157 CC(=O)NC1=NC=CC(Br)=C1 Z6551 [0,0,0,0,0,2|2,0,0]=4 423 B11R1.157 CC(=O)NC1=NC=CC(N)=C1 1694AC [0,0,0,0,0,2|2,0,0]=4 424 B11R1.157 CC(=O)NC1=NN=CC(C)=C1 5766AJ [0,0,0,0,0,2|2,0,0]=4 425 B11R1.157 CC1=CC=CC(CC(=O)O)=N1 X7036 [0,0,0,0,0,2|2,0,0]=4 426 B11R1.157 CC1=NC(CC(=O)[O-])=CC=C1 0758AP [0,0,0,0,0,2|2,0,0]=4