0 B9R0.53 CC(C)CC(=O)CC(C)C 1756AA [0,0,0,0,0,0|0,0,2]=2 1 B9R0.53 CC(C)C[C@H](N)CC(=O)O X3295 [0,0,0,0,0,0|3,0,1]=4 2 B9R0.53 CC(C)NC(=O)NC(C)C 2911AE [0,0,0,0,0,0|2,0,2]=4 3 B9R0.53 CC(C)OS(=O)OC(C)C 6518AB [0,0,0,0,0,0|3,0,1]=4 4 B8R0.28 CC(=O)CCCC(C)C 5697AC [1,0,0,0,0,0|1,0,1]=3 5 B8R0.28 CC(C)CCCC(C)O 6866AL [1,0,0,0,0,0|1,0,0]=2 6 B8R0.28 CC(C)COCC(C)C 7669AL [1,0,0,0,0,0|1,0,0]=2 7 B10R0.70 CC(C)CN(C=O)CC(C)C 2167AB [0,1,0,0,0,0|1,0,1]=3 8 B10R1.329 CC1=CC(O)CC(C)(C)C1 C423 [0,0,0,1,0,0|0,0,2]=3 9 B10R1.329 C[C@@H]1C[C@H](O)CC(C)(C)C1 7429AL [0,0,0,1,0,0|0,0,0]=1 10 B8R0.23 CC(C)CC(=O)N(C)C 5171AE [0,0,0,0,1,0|1,0,2]=4 11 B8R0.23 CC(C)CC(O)C(=O)O C466 [0,0,0,0,1,0|2,0,1]=4 12 B8R0.23 CC(C)C[C@@H](O)C(=O)O V4198 [0,0,0,0,1,0|2,0,1]=4 13 B8R0.23 CC(C)OC(=O)C(C)C 7796AF [0,0,0,0,1,0|1,0,2]=4 14 B10R0.96 CC(C)COC(=O)CC(C)C F508 [0,0,0,0,0,1|0,0,2]=3 15 B7R0.2 CCC(=O)CC(C)C 9385AB [2,0,0,0,0,0|0,0,2]=4 16 B7R0.2 CNC(C)CC(C)C 2627AF [2,0,0,0,0,0|2,0,0]=4 17 B7R0.4 CC(C)NCCCO 0839AE [2,0,0,0,0,0|2,0,0]=4 18 B7R0.7 CCCC(C)CCC 6609AL [2,0,0,0,0,0|1,0,0]=3 19 B7R0.7 CCCC(O)CCC 6512AL [2,0,0,0,0,0|0,0,0]=2 20 B7R0.7 CCCC(S)CCO U459 [2,0,0,0,0,0|1,1,0]=4 21 B9R1.34 CC1CC(C)CC(O)C1 7861AB [1,0,0,1,0,0|0,0,0]=2 22 B9R1.34 OC1CC(O)CC(O)C1 0465AB [1,0,0,1,0,0|2,0,0]=4 23 B9R1.38 CN1C[C@H](O)C[C@]1(C)O X6514 [1,0,0,1,0,0|2,0,0]=4 24 B9R1.66 CC1(C)CC(I)CCO1 2840AJ [1,0,0,1,0,0|2,0,0]=4 25 B9R1.66 CC1(C)CC(O)CCO1 1322AJ [1,0,0,1,0,0|1,0,0]=3 26 B9R1.49 CN1CCCC(O)CC1 W4100 [1,0,0,1,0,0|2,0,0]=4 27 B9R1.69 CC1CCC(O)CC1C 5905AL [0,0,0,1,1,0|2,0,0]=4 28 B11R1.166 CC1CCC(C(C)C)C(=O)C1 5752AF [0,1,0,1,0,0|0,0,2]=4 29 B11R1.1362 CC1(C)CC(=O)CC(C)(C)N1 P293 [0,1,0,1,0,0|0,0,2]=4 30 B11R1.1362 CC1(C)CC(=O)CC(C)(C)O1 Y7211 [0,1,0,1,0,0|0,0,2]=4 31 B11R1.80 CC1=NC(CC(C)C)SC1C L605 [0,1,0,1,0,0|2,0,0]=4 32 B7R0.5 CC(C)C(N)CCO 5799AJ [1,0,0,0,1,0|2,0,0]=4 33 B7R0.6 CC(Br)CCC(C)Br V1473 [1,0,0,0,1,0|2,0,0]=4 34 B7R0.6 CC(C)CCC(C)Br 5483AJ [1,0,0,0,1,0|1,0,0]=3 35 B7R0.6 CC(C)SSC(C)C W6227 [1,0,0,0,1,0|2,0,0]=4 36 B7R0.6 CC(O)CCC(C)O Q324 [1,0,0,0,1,0|2,0,0]=4 37 B7R0.6 CN(C)CCN(C)C 2336AA [1,0,0,0,1,0|2,0,0]=4 38 B7R0.6 CP(C)CCP(C)C X1004 [1,0,0,0,1,0|2,0,0]=4 39 B7R0.6 C[C@@H](O)CC[C@@H](C)O 4049AL [1,0,0,0,1,0|2,0,0]=4 40 B7R0.16 CC(C)[SiH](Cl)C(C)C 8579AJ [0,0,0,0,2,0|1,1,0]=4 41 B9R0.55 CC(=O)CCOCC(C)C 6549AL [1,0,0,0,0,1|1,0,1]=4