0 B6R0.3 CC(=O)C(=O)CCl 5581AE [0,0,0,0,0,0|3,0,1]=4 1 B6R0.3 CC(C)C(O)C#N 4772AD [0,0,0,0,0,0|2,0,2]=4 2 B6R0.3 CC(C)[C@H](N)CO 8725AA [0,0,0,0,0,0|3,0,1]=4 3 B6R0.3 CCC(=O)C(C)Br 5539AL [0,0,0,0,0,0|2,0,0]=2 4 B6R0.3 CCC(=O)C(C)S 5675AL [0,0,0,0,0,0|2,0,0]=2 5 B6R0.3 CCC(C)C(C)C 5239AL [0,0,0,0,0,0|2,0,1]=3 6 B6R0.3 CN(C)C(=O)CI 1440AC [0,0,0,0,0,0|3,0,0]=3 7 B6R0.3 CN(C)C(=O)CN W4015 [0,0,0,0,0,0|3,0,0]=3 8 B6R0.3 CN(C)C(=O)CN Z5718 [0,0,0,0,0,0|3,0,0]=3 9 B6R0.3 CN(C)C(=O)NN 2785AE [0,0,0,0,0,0|3,0,0]=3 10 B6R0.3 CN(C)C(=S)NN 8233AE [0,0,0,0,0,0|3,1,0]=4 11 B6R0.3 CNC(=O)C(C)Cl 3091AE [0,0,0,0,0,0|2,0,0]=2 12 B6R0.3 CNC(=O)C(F)Cl 5097AE [0,0,0,0,0,0|3,0,0]=3 13 B6R0.3 COC(=O)N(C)N 6989AD [0,0,0,0,0,0|2,0,0]=2 14 B6R0.3 COC(=O)[C@@H](C)Cl X3442 [0,0,0,0,0,0|1,0,0]=1 15 B6R0.3 COC(C)C(C)O V6491 [0,0,0,0,0,0|2,0,1]=3 16 B6R0.3 C\C=C(/C)C(C)=O 6105AL [0,0,0,0,0,0|3,0,1]=4 17 B5R0.1 C=COC(C)C 3476AL [1,0,0,0,0,0|2,0,1]=4 18 B5R0.1 CC#CC(C)C 6601AL [1,0,0,0,0,0|1,0,1]=3 19 B5R0.1 CC(C)=CCCl 7671AJ [1,0,0,0,0,0|2,0,1]=4 20 B5R0.1 CC(C)CCCl 7326AF [1,0,0,0,0,0|2,0,1]=4 21 B5R0.1 CC(C)CON 7310AJ [1,0,0,0,0,0|1,0,1]=3 22 B5R0.1 CC(C)C[Mg]Br 8722AJ [1,0,0,0,0,0|2,0,1]=4 23 B5R0.1 CC(C)N=[N+]=[N-] 8218AE [1,0,0,0,0,0|3,0,0]=4 24 B5R0.1 CC(O)CON 3604AB [1,0,0,0,0,0|2,0,1]=4 25 B5R0.1 CCC=C(C)C 7499AF [1,0,0,0,0,0|1,0,1]=3 26 B5R0.1 CCOC(C)C 7879AL [1,0,0,0,0,0|2,0,0]=3 27 B5R0.1 CCSC(C)C 7880AL [1,0,0,0,0,0|2,0,0]=3 28 B5R0.1 CNCC(C)C 8603AL [1,0,0,0,0,0|1,0,1]=3 29 B5R0.1 CNCC(C)O 5343AD [1,0,0,0,0,0|2,0,1]=4 30 B5R0.1 COCC(C)N 0442AC [1,0,0,0,0,0|1,0,1]=3 31 B5R0.1 COC[C@H](C)O W4988 [1,0,0,0,0,0|1,0,1]=3 32 B5R0.1 C\C=C\C(C)C 7501AF [1,0,0,0,0,0|1,0,0]=2 33 B5R0.3 C=C(SC)SC 4356AL [1,0,0,0,0,0|2,1,0]=4 34 B5R0.3 CCC(=O)CN X8894 [1,0,0,0,0,0|2,0,0]=3 35 B5R0.3 CCC(=O)CO X5132 [1,0,0,0,0,0|2,0,0]=3 36 B5R0.3 CCC(=S)OC R571 [1,0,0,0,0,0|0,1,0]=2 37 B5R0.3 CNC(=O)NN 9285AA [1,0,0,0,0,0|3,0,0]=4 38 B5R0.3 CO[SiH](C)OC I516 [1,0,0,0,0,0|2,1,0]=4 39 B5R0.3 C\C=C(/C)CC 0241AQ [1,0,0,0,0,0|2,0,0]=3 40 B5R0.3 C\C=C(/C)CC 9220AL [1,0,0,0,0,0|2,0,0]=3 41 B5R0.3 C\C=C(\C)CC 7440AL [1,0,0,0,0,0|2,0,0]=3 42 B5R0.5 C=C(C)C(C)C 5230AL [1,0,0,0,0,0|1,0,0]=2 43 B5R0.5 CC(=O)C(=O)[O-] 7017AF [1,0,0,0,0,0|1,0,2]=4 44 B5R0.5 CC(=O)C(C)F 0085AF [1,0,0,0,0,0|1,0,0]=2 45 B5R0.5 CC(N)C(C)O 7117AF [1,0,0,0,0,0|1,0,2]=4 46 B5R0.5 CC(O)C(=N)N 2094AL [1,0,0,0,0,0|3,0,0]=4 47 B5R0.5 CC(S)C(C)S 9352AJ [1,0,0,0,0,0|1,1,1]=4 48 B5R0.5 C[C@@H](O)C(=N)N X6061 [1,0,0,0,0,0|3,0,0]=4 49 B5R0.5 C[C@H](N)C(N)=O 7048AH [1,0,0,0,0,0|2,0,0]=3 50 B5R0.5 NC(=O)C(F)Br 3265AE [1,0,0,0,0,0|3,0,0]=4 51 B5R0.5 NC(=O)C(F)I 3275AE [1,0,0,0,0,0|3,0,0]=4 52 B5R0.5 O=C(O)C(=O)O 7001AF [1,0,0,0,0,0|2,0,1]=4 53 B5R0.5 O=C(O)C(Cl)Br 8168AB [1,0,0,0,0,0|2,0,0]=3 54 B5R0.5 O=C(O)C(F)Br 8446AJ [1,0,0,0,0,0|2,0,0]=3 55 B5R0.5 O=C(O)C(F)Cl 4068AE [1,0,0,0,0,0|2,0,0]=3 56 B5R0.5 O=C([O-])C(F)Br 8443AE [1,0,0,0,0,0|2,0,1]=4 57 B5R0.5 O=C([O-])C(F)I 0009AD [1,0,0,0,0,0|2,0,1]=4 58 B7R0.5 C=C(Br)C(=O)OCC Y5466 [0,1,0,0,0,0|1,0,2]=4 59 B7R0.5 CC(C)C(N)CCO 5799AJ [0,1,0,0,0,0|2,0,1]=4 60 B7R0.5 CC(C)N(C)CCO 2902AB [0,1,0,0,0,0|3,0,0]=4 61 B7R0.5 CCCC(=O)C(C)C 5712AL [0,1,0,0,0,0|1,0,0]=2 62 B7R0.5 CCCC(O)C(C)C 5711AL [0,1,0,0,0,0|1,0,2]=4 63 B7R0.5 COCC(N)C(C)C 9904AH [0,1,0,0,0,0|1,0,1]=3 64 B7R0.10 C=C(CCl)C(=O)OC X7009 [0,1,0,0,0,0|0,0,2]=3 65 B7R0.10 CCC(=O)C(O)CC 8871AL [0,1,0,0,0,0|2,0,0]=3 66 B7R0.10 CCC(C)C(=O)NN 8409AE [0,1,0,0,0,0|2,0,0]=3 67 B7R0.10 CCC(C)C(C)CC 5907AL [0,1,0,0,0,0|2,0,1]=4 68 B7R0.10 CC[C@@H](O)C(=O)OC 9868AL [0,1,0,0,0,0|1,0,0]=2 69 B7R0.10 CC[C@H](O)C(=O)OC 9869AL [0,1,0,0,0,0|1,0,0]=2 70 B7R0.10 COC(=O)C(=O)NN 7238AE [0,1,0,0,0,0|2,0,1]=4 71 B7R0.10 COC(=O)C(Cl)C=O 7018AD [0,1,0,0,0,0|1,0,1]=3 72 B7R0.10 COC(=O)C(F)CO 0323AC [0,1,0,0,0,0|1,0,0]=2 73 B7R0.10 COC(=O)C(O)CO 0209AP [0,1,0,0,0,0|1,0,0]=2 74 B7R0.10 COC(=O)[C@@H](C)CBr 4140AL [0,1,0,0,0,0|0,0,0]=1 75 B7R0.10 COC(=O)[C@@H](C)CO X3276 [0,1,0,0,0,0|0,0,0]=1 76 B7R0.10 COC(C)C(=O)NN 2016AF [0,1,0,0,0,0|2,0,0]=3 77 B7R0.10 C\C=C(/Br)C(=O)OC 3521AL [0,1,0,0,0,0|1,0,1]=3 78 B7R0.14 CC(C)(C)C(=O)CN 2819AC [0,1,0,0,0,0|2,0,0]=3 79 B7R0.14 CC(C)(C)\C(N)=N\O 3237AE [0,1,0,0,0,0|3,0,0]=4 80 B7R0.14 CNC(=O)C(C)(C)N 0533AF [0,1,0,0,0,0|1,0,0]=2 81 B7R0.14 CNC(C)C(C)(C)C 2628AF [0,1,0,0,0,0|2,0,1]=4 82 B7R0.15 COC(OC)N(C)C J70072 [0,1,0,0,0,0|1,0,2]=4 83 B7R0.16 CC(=O)C(=O)C(C)Br Y2126 [0,1,0,0,0,0|2,0,0]=3 84 B7R0.16 CC(C)C(C)C(C)C 7982AF [0,1,0,0,0,0|2,0,1]=4 85 B7R0.16 CC(Cl)C(=O)N(C)C 7847AC [0,1,0,0,0,0|2,0,0]=3 86 B7R1.4 CC1=CCOC1=O 7576AD [0,0,0,1,0,0|0,0,2]=3 87 B7R1.4 CC1C=NNC1=O 1336AQ [0,0,0,1,0,0|2,0,1]=4 88 B7R1.4 CC1CCCC1N 5365AE [0,0,0,1,0,0|2,0,1]=4 89 B7R1.4 CC1CCNC1=O Y8455 [0,0,0,1,0,0|1,0,0]=2 90 B7R1.4 C[C@@H]1CCC[C@@H]1O 3213AL [0,0,0,1,0,0|1,0,2]=4 91 B7R1.4 ClC1CCOC1Cl 5221AL [0,0,0,1,0,0|2,0,1]=4 92 B7R1.4 NC1CCNC1=O 0020AD [0,0,0,1,0,0|2,0,0]=3 93 B7R1.4 N[C@@H]1CCNC1=O X9462 [0,0,0,1,0,0|2,0,0]=3 94 B7R1.4 N[C@H]1CCSC1=O S502 [0,0,0,1,0,0|1,1,0]=3 95 B7R1.4 O=C1CCCC1Br X5623 [0,0,0,1,0,0|2,0,0]=3 96 B7R1.4 O=C1CCCC1Cl W7923 [0,0,0,1,0,0|2,0,0]=3 97 B7R1.4 O=C1OCC[C@H]1O 8329AB [0,0,0,1,0,0|1,0,0]=2 98 B7R1.22 CCC(N)C1CC1 7479AD [0,0,0,1,0,0|2,0,1]=4 99 B7R1.22 COC(=O)C1CN1 6374AE [0,0,0,1,0,0|1,0,0]=2 100 B7R1.22 N\C(=N/O)C1CC1 1453AB [0,0,0,1,0,0|3,0,0]=4 101 B7R1.22 [C@H]1(C(=O)OC)CO1 R140 [0,0,0,1,0,0|1,0,0]=2 102 B7R0.2 CC(C)NC(=O)CBr 1764AC [0,0,0,0,0,1|2,0,0]=3 103 B7R0.2 CC(C)NC(=O)CN 6712AE [0,0,0,0,0,1|2,0,0]=3 104 B7R0.2 CC(O)CC(=O)NN 8247AD [0,0,0,0,0,1|3,0,0]=4 105 B7R0.2 CCC(C)CC(C)C 5322AL [0,0,0,0,0,1|2,0,1]=4 106 B7R0.2 CN(C)CC(=O)NN W6825 [0,0,0,0,0,1|3,0,0]=4 107 B7R0.2 CNC(=O)NC(C)=O 7251AF [0,0,0,0,0,1|2,0,1]=4 108 B7R0.2 COC(=O)CC(N)=S 7011AJ [0,0,0,0,0,1|2,0,1]=4 109 B7R0.2 COC(C)CC(C)O 5636AH [0,0,0,0,0,1|2,0,1]=4 110 B4R0.1 CC(=O)NBr 6847AF [2,0,0,0,0,0|2,0,0]=4 111 B4R0.1 CCC(=O)Br C859 [2,0,0,0,0,0|1,0,0]=3 112 B4R0.1 CSC(C)=O 9061AJ [2,0,0,0,0,0|0,1,0]=3 113 B4R0.1 CSC(C)C 8107AL [2,0,0,0,0,0|0,1,0]=3 114 B4R0.1 CS[S+](C)C 7703AL [2,0,0,0,0,0|1,1,0]=4 115 B4R0.1 C\C=C(/C)Cl 5560AL [2,0,0,0,0,0|1,0,1]=4 116 B4R0.1 C\C=C(\C)Cl 4247AL [2,0,0,0,0,0|1,0,1]=4 117 B4R0.1 NCC(=O)O 7986AL [2,0,0,0,0,0|1,0,0]=3 118 B4R0.1 NCC(=O)[O-] P522 [2,0,0,0,0,0|1,0,1]=4 119 B4R0.1 NCC(=O)[O-] Z1943 [2,0,0,0,0,0|1,0,1]=4 120 B4R0.2 CCCOC 4896AL [2,0,0,0,0,0|0,0,1]=3 121 B4R0.2 CCCSC U677 [2,0,0,0,0,0|0,1,1]=4 122 B4R0.2 CCNCC 7650AL [2,0,0,0,0,0|2,0,0]=4 123 B4R0.2 C\C=C/CC 7428AL [2,0,0,0,0,0|1,0,0]=3 124 B4R0.2 C\C=C\SC AMTGC066 [2,0,0,0,0,0|0,1,1]=4 125 B6R0.1 CCCC(C)CC 7810AF [1,1,0,0,0,0|1,0,1]=4 126 B6R0.1 CCCC(C)CO 1207AA [1,1,0,0,0,0|1,0,1]=4 127 B6R0.1 CCNC(C)CC 7145AD [1,1,0,0,0,0|2,0,0]=4 128 B6R0.1 CCOC(C)CN 0082AD [1,1,0,0,0,0|2,0,0]=4 129 B6R0.1 CCOC(C)CN Y4465 [1,1,0,0,0,0|2,0,0]=4 130 B6R0.1 CC[C@@H](N)COC 8948AH [1,1,0,0,0,0|1,0,1]=4 131 B6R0.1 CC[C@H](N)COC 9106AH [1,1,0,0,0,0|1,0,1]=4 132 B6R0.1 CNCC(C)OC 1691AF [1,1,0,0,0,0|1,0,1]=4 133 B6R0.2 CC(C)CC(C)C 7809AF [1,1,0,0,0,0|1,0,1]=4 134 B6R0.2 CC(C)CC(C)N I823 [1,1,0,0,0,0|1,0,1]=4 135 B6R0.4 CC(C)CCCCl 6814AE [1,1,0,0,0,0|1,0,1]=4 136 B6R0.4 CC(C)CCCN 7575AF [1,1,0,0,0,0|1,0,1]=4 137 B6R0.4 CC(C)NCCCl 9576AB [1,1,0,0,0,0|2,0,0]=4 138 B6R0.4 CC(C)OCCN 2664AC [1,1,0,0,0,0|2,0,0]=4 139 B6R0.4 CCCC=C(C)C 5704AL [1,1,0,0,0,0|1,0,1]=4 140 B6R0.4 CCCCC(C)C 5734AL [1,1,0,0,0,0|1,0,1]=4 141 B6R0.4 CCCNC(C)C 7560AH [1,1,0,0,0,0|1,0,1]=4 142 B6R0.4 CCCSC(C)C 8111AL [1,1,0,0,0,0|1,0,1]=4 143 B6R0.4 C\C=C\CC(C)C 6798AL [1,1,0,0,0,0|1,0,0]=3 144 B6R0.5 CCNC(C)(C)C 3737AE [1,1,0,0,0,0|2,0,0]=4 145 B6R0.5 CNCC(C)(C)C 0063AE [1,1,0,0,0,0|1,0,1]=4 146 B6R0.8 COP(=O)(O)OC V7851 [1,1,0,0,0,0|2,0,0]=4 147 B6R0.9 CCC(CN)OC X2088 [1,1,0,0,0,0|1,0,1]=4 148 B6R0.9 CCC(CO)OC 5682AL [1,1,0,0,0,0|0,0,2]=4 149 B6R0.9 CCC(OC)OC 8873AL [1,1,0,0,0,0|0,0,2]=4 150 B6R0.7 CC(=O)C(C)(C)Br Y1567 [1,1,0,0,0,0|0,0,0]=2 151 B6R0.7 CC(=O)C(C)(C)O X0229 [1,1,0,0,0,0|0,0,0]=2 152 B6R0.7 CC(C)(C)S(=O)Cl 0001AE [1,1,0,0,0,0|2,0,0]=4 153 B6R0.7 CC(C)(Cl)C(=O)O 8852AB [1,1,0,0,0,0|0,0,0]=2 154 B6R0.7 CC(C)(N)C(N)=O 5432AJ [1,1,0,0,0,0|1,0,0]=3 155 B6R0.7 CC(C)(N)C(N)=O 5907AD [1,1,0,0,0,0|1,0,0]=3 156 B6R0.7 CC(C)C(C)(C)C 5081AL [1,1,0,0,0,0|1,0,1]=4 157 B6R0.7 CC(C)C(C)(C)N Y5738 [1,1,0,0,0,0|1,0,1]=4 158 B6R0.7 CC(C)S(=O)(=O)[O-] 7069AF [1,1,0,0,0,0|1,0,1]=4 159 B6R0.7 CC(C)[Si](C)(C)Cl 8728AJ [1,1,0,0,0,0|1,1,0]=4 160 B6R0.7 CC(N)C(C)(C)C 2177AE [1,1,0,0,0,0|1,0,1]=4 161 B6R0.7 CC(N)P(=O)(O)O 9663AJ [1,1,0,0,0,0|2,0,0]=4 162 B8R0.2 CNC(=O)C(N)C(C)C 6354AD [0,1,0,0,0,1|1,0,0]=3 163 B8R0.2 COC(=O)C(=O)C(C)C 7036AJ [0,1,0,0,0,1|0,0,0]=2 164 B8R0.2 COC(=O)C(Br)=C(C)C 4627AE [0,1,0,0,0,1|0,0,1]=3 165 B8R0.2 COC(=O)C(N)C(C)=O 0522AC [0,1,0,0,0,1|1,0,1]=4 166 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O X4361 [0,1,0,0,0,1|1,0,0]=3 167 B8R0.2 COC(=O)[C@H](O)C(C)C 9860AL [0,1,0,0,0,1|0,0,0]=2 168 B8R0.5 CC(C)NC(=O)CCN 9774AC [0,1,0,0,0,1|1,0,0]=3 169 B8R0.5 CCCC(=O)NC(C)C 4245AA [0,1,0,0,0,1|1,0,0]=3 170 B8R0.5 CCOC(=O)CC(C)Br 1536AC [0,1,0,0,0,1|1,0,0]=3 171 B8R0.5 CCOC(=O)CN(C)C 3848AB [0,1,0,0,0,1|1,0,0]=3 172 B8R0.5 CNCC(=O)NC(C)C 1017AD [0,1,0,0,0,1|1,0,0]=3 173 B8R0.5 CNCC(=O)NC(C)C 4697AE [0,1,0,0,0,1|1,0,0]=3 174 B8R0.5 COCC(=O)CC(C)=O W7487 [0,1,0,0,0,1|1,0,1]=4 175 B8R0.16 CO\C(C=O)=C\N(C)C X9940 [0,1,0,0,0,1|1,0,0]=3 176 B8R0.19 CCC(C)NC(=O)CCl 0194AE [0,1,0,0,0,1|2,0,0]=4 177 B8R0.19 CCC(C)NC(=O)CN 1865AD [0,1,0,0,0,1|2,0,0]=4 178 B8R0.19 CC[C@H](O)CC(=O)OC 5880AB [0,1,0,0,0,1|1,0,0]=3 179 B8R0.19 COC(=O)C[C@H](O)CO 5051AC [0,1,0,0,0,1|1,0,0]=3 180 B8R0.23 CC(=O)C(=O)CC(C)C 6793AL [0,1,0,0,0,1|1,0,0]=3 181 B8R0.23 CC(C)CC(=O)C(=O)O 2659AC [0,1,0,0,0,1|2,0,0]=4 182 B8R0.23 CC(C)NC(=O)C(C)C 1083AF [0,1,0,0,0,1|1,0,0]=3 183 B8R0.23 CC(C)NC(=O)C(C)Cl 3092AE [0,1,0,0,0,1|1,0,0]=3 184 B8R0.23 CC(C)NC(=O)C(C)N 2921AD [0,1,0,0,0,1|1,0,0]=3 185 B8R0.23 CC(C)OC(=O)C(C)C 7796AF [0,1,0,0,0,1|1,0,0]=3 186 B8R0.24 CC(C)(C)NC(=O)CN 8528AE [0,1,0,0,0,1|2,0,0]=4 187 B8R0.24 CC(C)(C)OC(=O)CI X6904 [0,1,0,0,0,1|2,0,0]=4 188 B8R0.24 COC(=O)CC(F)(F)F 6331AD [0,1,0,0,0,1|2,0,0]=4 189 B8R0.3 C#CC[C@H](N)C(=O)OC 8457AA [0,2,0,0,0,0|1,0,0]=3 190 B8R0.3 C=C(CCl)C(=O)OCC 5041AL [0,2,0,0,0,0|0,0,2]=4 191 B8R0.3 C=C(CO)C(=O)OCC X8486 [0,2,0,0,0,0|0,0,2]=4 192 B8R0.3 C=CCC(N)C(=O)OC 4218AJ [0,2,0,0,0,0|1,0,0]=3 193 B8R0.3 C=CC[C@@H](N)C(=O)OC 1043AB [0,2,0,0,0,0|1,0,0]=3 194 B8R0.3 CCCC(=O)C(C)CC 7877AA [0,2,0,0,0,0|1,0,0]=3 195 B8R0.3 CCCC(N)C(=O)NC 1487AF [0,2,0,0,0,0|2,0,0]=4 196 B8R0.3 CNCC(C)C(=O)OC Z2743 [0,2,0,0,0,0|0,0,0]=2 197 B8R0.3 COC(=O)[C@H](C)N=C=S 8737AD [0,2,0,0,0,0|0,0,1]=3 198 B8R0.3 COC(=O)[C@H](C)NC=O 7006AH [0,2,0,0,0,0|0,0,1]=3 199 B8R0.8 C=CCNC(=O)C(C)N 2874AD [0,2,0,0,0,0|2,0,0]=4 200 B8R0.8 C=CCOC(=O)[C@H](C)N 6180AB [0,2,0,0,0,0|1,0,0]=3 201 B8R0.8 CC(N)C(=O)NCCO 2846AD [0,2,0,0,0,0|2,0,0]=4 202 B8R0.8 CCCCC(=O)C(C)C 5543AA [0,2,0,0,0,0|1,0,0]=3 203 B8R0.8 CCCOC(=O)[C@H](C)O 7652AB [0,2,0,0,0,0|1,0,0]=3 204 B8R0.8 CCOCC(N)C(C)C 0358AD [0,2,0,0,0,0|1,0,1]=4 205 B8R0.8 CN(C)C(=O)CCCCl 7775AD [0,2,0,0,0,0|2,0,0]=4 206 B8R0.12 CC(C)S(=O)(=O)CCN 3529AB [0,2,0,0,0,0|2,0,0]=4 207 B8R0.14 CCNC(=O)C(C)(C)N 2418AD [0,2,0,0,0,0|1,0,0]=3 208 B8R0.14 CCOC(=O)C(F)(Br)Br 8651AJ [0,2,0,0,0,0|2,0,0]=4 209 B8R0.14 CCOC(=O)C(F)(F)F J70052 [0,2,0,0,0,0|2,0,0]=4 210 B8R0.13 CCC(=O)C(C)(C)C=O 1854AL [0,2,0,0,0,0|1,0,0]=3 211 B8R0.13 COC(=O)C(C)(Br)CBr 1735AE [0,2,0,0,0,0|0,0,0]=2 212 B8R0.13 COC(=O)C(Cl)(Cl)OC 8549AJ [0,2,0,0,0,0|1,0,0]=3 213 B8R0.20 CCC(OC)C(=O)NN 8098AC [0,2,0,0,0,0|2,0,0]=4 214 B8R0.20 COC(=O)C(CN)CN Z4762 [0,2,0,0,0,0|0,0,0]=2 215 B8R0.27 CC(C)C(=O)C(F)(F)F 2077AE [0,2,0,0,0,0|2,0,0]=4 216 B8R0.27 CN(C)C(=O)C(C)(C)N 7179AC [0,2,0,0,0,0|1,0,0]=3 217 B8R0.18 CN[C@@H](C(=O)O)C(C)C Z5749 [0,2,0,0,0,0|1,0,1]=4 218 B6R1.2 CC1=CCCC1 9313AJ [1,0,0,1,0,0|1,0,1]=4 219 B6R1.2 CC1CCCN1 0591AQ [1,0,0,1,0,0|2,0,0]=4 220 B6R1.2 CC1CCCS1 7972AJ [1,0,0,1,0,0|2,0,0]=4 221 B6R1.2 CC1CCNC1 X9461 [1,0,0,1,0,0|1,0,1]=4 222 B6R1.2 CC1CCOC1 6124AL [1,0,0,1,0,0|0,0,1]=3 223 B6R1.2 CC1COCO1 6593AL [1,0,0,1,0,0|1,0,1]=4 224 B6R1.2 C[C@@H]1CCNC1 1585AB [1,0,0,1,0,0|1,0,1]=4 225 B6R1.2 C[C@H]1CCNC1 W4034 [1,0,0,1,0,0|1,0,1]=4 226 B6R1.2 NC1CCOC1 W9158 [1,0,0,1,0,0|1,0,1]=4 227 B6R1.3 CCNC1CC1 2347AB [1,0,0,1,0,0|2,0,0]=4 228 B6R1.3 CCNC1CC1 3977AJ [1,0,0,1,0,0|2,0,0]=4 229 B6R1.3 CCNC1CC1 4401AJ [1,0,0,1,0,0|2,0,0]=4 230 B6R1.3 COCC1CO1 1812AL [1,0,0,1,0,0|1,0,1]=4 231 B6R1.3 COC[C@@H]1CO1 9238AJ [1,0,0,1,0,0|1,0,1]=4 232 B6R1.3 COC[C@H]1CO1 9221AJ [1,0,0,1,0,0|1,0,1]=4 233 B6R1.10 CC1(C)CCN1 Y7008 [1,0,0,1,0,0|2,0,0]=4 234 B6R1.10 CC1(N)COC1 6470AA [1,0,0,1,0,0|1,0,1]=4 235 B6R1.10 CC1(N)COC1 W8972 [1,0,0,1,0,0|1,0,1]=4 236 B8R1.4 CC1CC(=O)CCN1 1072AC [0,0,0,1,0,1|2,0,0]=4 237 B8R1.4 CC1CC(=O)CCN1 6568AA [0,0,0,1,0,1|2,0,0]=4 238 B8R1.4 CC1CCN=C(N)S1 1614AH [0,0,0,1,0,1|2,0,0]=4 239 B8R1.4 CC1CCOC(C)O1 5310AL [0,0,0,1,0,1|1,0,1]=4 240 B8R1.4 CC1CNCC(=O)N1 3610AJ [0,0,0,1,0,1|2,0,0]=4 241 B8R1.4 CC1COCC(=O)N1 V7159 [0,0,0,1,0,1|2,0,0]=4 242 B8R1.4 CN1CCCC(=O)C1 9933AH [0,0,0,1,0,1|2,0,0]=4 243 B8R1.4 CN1CCCC(=O)C1 9934AH [0,0,0,1,0,1|2,0,0]=4 244 B8R1.4 CN1CCCC(=O)C1 W6919 [0,0,0,1,0,1|2,0,0]=4 245 B8R1.4 C[C@@H]1CNCC(=O)N1 9027AH [0,0,0,1,0,1|2,0,0]=4 246 B8R1.4 O=C1C[C@@H](O)CCN1 W6428 [0,0,0,1,0,1|2,0,0]=4 247 B8R1.51 CC1(C)CC(=O)CS1 3715AB [0,0,0,1,0,1|2,0,0]=4 248 B8R1.51 CC1(C)CCC(=O)C1 V4062 [0,0,0,1,0,1|1,0,0]=3 249 B8R1.51 CC1(C)CNC(=O)O1 2855AL [0,0,0,1,0,1|1,0,0]=3 250 B8R1.51 CC1(C)COC(=O)C1 2579AL [0,0,0,1,0,1|0,0,0]=2 251 B8R1.51 CC1(C)OCC(=O)O1 5725AB [0,0,0,1,0,1|2,0,0]=4 252 B8R1.5 CC1CCCOC1=O 3885AL [0,1,0,1,0,0|0,0,0]=2 253 B8R1.5 CC1COCCC1=O Z3955 [0,1,0,1,0,0|1,0,0]=3 254 B8R1.5 CC1OCCNC1=O 5590AJ [0,1,0,1,0,0|1,0,0]=3 255 B8R1.5 CN1CCNCC1=O 1842AA [0,1,0,1,0,0|2,0,0]=4 256 B8R1.5 CN1CCNCC1=O 7723AJ [0,1,0,1,0,0|2,0,0]=4 257 B8R1.5 C[C@@H]1NCCNC1=O 2295AC [0,1,0,1,0,0|1,0,0]=3 258 B8R1.5 C[C@H]1NCCNC1=O 5574AC [0,1,0,1,0,0|1,0,0]=3 259 B8R1.5 NC1CCCCC1=O 0726AC [0,1,0,1,0,0|2,0,0]=4 260 B8R1.5 N[C@@H]1CCCNC1=O 4620AC [0,1,0,1,0,0|2,0,0]=4 261 B8R1.5 N[C@H]1CCCNC1=O 4844AJ [0,1,0,1,0,0|2,0,0]=4 262 B8R1.5 O=C1CCCCC1Cl 7902AJ [0,1,0,1,0,0|2,0,0]=4 263 B8R1.5 O=C1NCCCC1Br 4146AB [0,1,0,1,0,0|2,0,0]=4 264 B8R1.7 CC(C)C1=NCCO1 5673AL [0,1,0,1,0,0|1,0,0]=3 265 B8R1.19 CC1(C)CCNC1=O 4182AE [0,1,0,1,0,0|1,0,0]=3 266 B8R1.19 CC1(C)OC=CC1=O 0580AQ [0,1,0,1,0,0|1,0,1]=4 267 B8R1.37 CCOC(=O)[C@H]1CO1 3304AL [0,1,0,1,0,0|1,0,0]=3 268 B8R1.37 COCC(=O)C1CC1 8478AA [0,1,0,1,0,0|0,0,0]=2 269 B8R1.54 CC(Br)C(=O)C1CC1 5469AJ [0,1,0,1,0,0|1,0,0]=3 270 B8R1.54 O=C(O)C(=O)C1CC1 Z4141 [0,1,0,1,0,0|2,0,0]=4 271 B8R1.11 O=C1CCCN1CO 7398AF [0,1,0,1,0,0|2,0,0]=4 272 B8R1.38 COC(=O)C1CCN1 3825AJ [0,1,0,1,0,0|0,0,0]=2 273 B8R1.38 COC(=O)C1CCN1 6194AA [0,1,0,1,0,0|0,0,0]=2 274 B8R1.39 CC1(C(=O)NN)CC1 8813AE [0,1,0,1,0,0|2,0,0]=4 275 B8R1.39 COC(=O)C1(C)CC1 6825AE [0,1,0,1,0,0|0,0,0]=2 276 B8R1.39 COC(=O)C1(C)CO1 1431AQ [0,1,0,1,0,0|0,0,0]=2 277 B8R1.50 CC1=C(C)C(=O)NC1 2679AE [0,1,0,1,0,0|1,0,1]=4 278 B8R1.50 CC1=NOC(=O)C1C W3412 [0,1,0,1,0,0|1,0,0]=3 279 B8R1.50 CC1CCN(C)C1=O Y8129 [0,1,0,1,0,0|1,0,0]=3 280 B8R1.50 CN1C(=O)CCC1O 5649AB [0,1,0,1,0,0|2,0,0]=4 281 B8R1.50 CN1C(=O)COC1=O 4361AD [0,1,0,1,0,0|1,0,1]=4 282 B8R1.50 CN1CCC(Br)C1=O 0624AE [0,1,0,1,0,0|2,0,0]=4 283 B8R1.50 CN1CCC(N)C1=O 0714AD [0,1,0,1,0,0|2,0,0]=4 284 B8R1.50 CN1CCC(N)C1=O 2120AJ [0,1,0,1,0,0|2,0,0]=4 285 B8R0.9 CC(C)CNC(=O)CBr 4255AF [0,0,0,0,0,2|2,0,0]=4 286 B8R0.9 CC(C)CNC(=O)CN 5727AD [0,0,0,0,0,2|2,0,0]=4 287 B8R0.9 CC(C)OCC(=O)NN 2431AF [0,0,0,0,0,2|2,0,0]=4 288 B8R0.9 CCC(=O)CCC(C)C 7962AF [0,0,0,0,0,2|1,0,0]=3 289 B8R0.9 COC(=O)CNC(C)=O 3516AL [0,0,0,0,0,2|1,0,1]=4 290 B8R0.9 COC(=O)\C=C\C(C)=O 7011AL [0,0,0,0,0,2|1,0,1]=4