0 B9R0.44 C=CCC(=O)OC(C)(C)C 9031AL [0,0,0,0,0,0|3,0,1]=4 1 B8R0.5 CCCC(C)CC(C)C 5321AL [1,0,0,0,0,0|1,0,1]=3 2 B8R0.21 CC(C)(C)NCCCN 4862AE [1,0,0,0,0,0|2,0,1]=4 3 B8R0.21 CC(C)(C)OCCC#N 4724AF [1,0,0,0,0,0|2,0,1]=4 4 B8R0.21 CC(C)(C)OCCCN 7556AH [1,0,0,0,0,0|2,0,1]=4 5 B8R0.24 CCC(C)CC(C)(C)C 5091AL [1,0,0,0,0,0|0,0,1]=2 6 B10R0.31 CC(=O)CC(=O)SC(C)(C)C 4069AH [0,1,0,0,0,0|2,0,1]=4 7 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C 7985AF [0,1,0,0,0,0|2,0,0]=3 8 B10R0.48 CC(C)(C)CC(C)(C)NC=O 8303AL [0,1,0,0,0,0|1,0,0]=2 9 B10R1.329 CC1(C)CC(=O)CC(=O)N1 W6723 [0,0,0,1,0,0|2,0,1]=4 10 B10R1.329 CC1CC(C)CC(C)(C)C1 4336AL [0,0,0,1,0,0|1,0,1]=3 11 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 9216AL [0,0,0,1,0,0|0,0,2]=3 12 B8R0.14 CCCC(C)C(C)(C)O 7989AF [0,0,0,0,1,0|2,0,1]=4 13 B7R0.2 CCC(C)CC(C)C 5322AL [2,0,0,0,0,0|0,0,1]=3 14 B7R0.4 CC(C)CCCCO 6988AE [2,0,0,0,0,0|0,0,2]=4 15 B7R0.4 CC(C)CCN=C=O 5158AD [2,0,0,0,0,0|1,0,1]=4 16 B7R0.4 CCCCCC(C)C 5733AL [2,0,0,0,0,0|1,0,1]=4 17 B7R0.7 CCCC(C)CCO 6091AL [2,0,0,0,0,0|0,0,2]=4 18 B7R0.8 CC(C)(C)OCCN 4886AH [2,0,0,0,0,0|2,0,0]=4 19 B7R0.8 CC(C)(O)CCCN 6321AJ [2,0,0,0,0,0|2,0,0]=4 20 B7R0.8 CCCCC(C)(C)C 5136AL [2,0,0,0,0,0|0,0,1]=3 21 B7R0.8 CNCCC(C)(C)C 9066AC [2,0,0,0,0,0|1,0,1]=4 22 B7R0.9 CC(=O)OC(C)(C)C Y7726 [2,0,0,0,0,0|1,0,1]=4 23 B7R0.9 CN(C)CC(C)(C)N 9307AJ [2,0,0,0,0,0|2,0,0]=4 24 B9R0.34 CCCC(C)CC(C)CC 5939AL [1,1,0,0,0,0|1,0,1]=4 25 B9R0.53 CC(=O)CC(C)CC(C)C 0099AB [1,1,0,0,0,0|0,0,0]=2 26 B9R0.53 CC(C)C[C@@H](N)CC(=O)O 5270AC [1,1,0,0,0,0|1,0,0]=3 27 B9R0.53 CC(C)C[C@@H](N)CC(=O)O 5354AA [1,1,0,0,0,0|1,0,0]=3 28 B9R0.38 CNCCCNC(C)(C)C 9103AD [1,1,0,0,0,0|2,0,0]=4 29 B9R0.38 COCCNCC(C)(C)C 7883AC [1,1,0,0,0,0|2,0,0]=4 30 B9R0.56 CC(=O)OCC[N+](C)(C)C X7331 [1,1,0,0,0,0|2,0,0]=4 31 B9R0.56 CC(=O)SCC[N+](C)(C)C 7815AF [1,1,0,0,0,0|2,0,0]=4 32 B9R0.56 CC(C)(C)CNCC(=O)O Y6728 [1,1,0,0,0,0|1,0,0]=3 33 B9R0.30 [C-]#[N+]C(C)(C)CC(C)(C)C 4334AL [1,1,0,0,0,0|1,0,1]=4 34 B9R0.57 CC(C)(C)CC(N)C(=O)O X5326 [1,1,0,0,0,0|1,0,0]=3 35 B9R0.57 CC(C)(C)CC(N)C(=O)O X8798 [1,1,0,0,0,0|1,0,0]=3 36 B9R0.10 CC(=O)CC(=O)C(C)(C)C 1341AC [0,1,0,0,1,0|1,0,1]=4 37 B11R0.308 C[C@@H](OC(C)(C)C)[C@@H](N)C(=O)O Z8086 [0,2,0,0,0,0|1,0,0]=3 38 B11R0.308 C[C@@H](OC(C)(C)C)[C@H](N)C(N)=O 4237AH [0,2,0,0,0,0|1,0,0]=3 39 B11R0.308 C[C@H](OC(C)(C)C)[C@H](N)C(=O)O 7058AH [0,2,0,0,0,0|1,0,0]=3 40 B11R0.359 CC(CC(C)(C)C)CC(C)(C)C Y1189 [0,2,0,0,0,0|1,0,1]=4 41 B9R1.13 CC(C)CC1CCNC1 4475AF [1,0,0,1,0,0|1,0,1]=4 42 B9R1.34 CC1CC(=O)CC(C)N1 1417AJ [1,0,0,1,0,0|1,0,0]=3 43 B9R1.34 CC1CC(=O)CC(C)N1 7189AC [1,0,0,1,0,0|1,0,0]=3 44 B9R1.34 CC1CC(=O)CC(C)O1 1555AA [1,0,0,1,0,0|1,0,0]=3 45 B9R1.34 CC1CC(C)CC(C)C1 4493AL [1,0,0,1,0,0|1,0,1]=4 46 B9R1.34 C[C@H]1CC(=O)C[C@@H](C)N1 3929AJ [1,0,0,1,0,0|1,0,0]=3 47 B11R2.466 O=C1CC(=O)CC2(CC2)C1 4753AC [0,0,0,2,0,0|1,0,1]=4 48 B7R0.14 CC(C)(C)C(O)CN 1562AL [1,0,0,0,1,0|2,0,0]=4 49 B7R0.14 CNC(C)C(C)(C)C 2628AF [1,0,0,0,1,0|1,0,1]=4