0 B9R0.53 CC(C)CC(=O)NC(C)C CSC000157551 [0,0,0,0,0,0|1,0,0]=1 1 B9R0.53 CC(C)CC(=O)OC(C)C CSC000170143 [0,0,0,0,0,0|1,0,0]=1 2 B8R0.28 CC(C)CSCC(C)C CSC000031121 [1,0,0,0,0,0|1,0,0]=2 3 B10R0.165 CC(C)NS(=O)(=O)NC(C)C CSC013246380 [0,1,0,0,0,0|3,0,0]=4 4 B10R1.54 CC(C)CN1CCC(C1)C CSC047749369 [0,0,0,1,0,0|2,0,0]=3 5 B10R1.54 CC(C)CN1CC[C@@H](C1)N CSC012183901 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.54 CC(C)NC1CCC(C1)C CSC012091168 [0,0,0,1,0,0|2,0,1]=4 7 B10R1.59 CC(C)N1N=C(CC1=O)C CSC011441405 [0,0,0,1,0,0|2,0,1]=4 8 B10R0.96 CC(C)CC(=O)NCC(=O)O CSC000194594 [0,0,0,0,0,1|2,0,1]=4 9 B10R0.96 CC(C)CNC(=O)CC(C)C CSC000160783 [0,0,0,0,0,1|0,0,0]=1 10 B10R0.96 CC(C)OC(=O)CCC(=O)C CSC000031084 [0,0,0,0,0,1|2,0,1]=4 11 B9R0.4 CC(C)CC(=O)OCC=C CSC000006416 [1,1,0,0,0,0|0,0,2]=4 12 B9R0.4 CC(C)NC(=O)NCCN CSC011374587 [1,1,0,0,0,0|2,0,0]=4 13 B9R0.4 CCCCC(=O)OC(C)C CSC000169914 [1,1,0,0,0,0|1,0,0]=3 14 B9R0.4 CCCNC(=O)NC(C)C CSC000163085 [1,1,0,0,0,0|1,0,0]=3 15 B9R0.4 CCCOC(=O)CC(C)C CSC000170144 [1,1,0,0,0,0|0,0,0]=2 16 B9R0.4 CNCCC(=O)NC(C)C CSC011534604 [1,1,0,0,0,0|1,0,0]=3 17 B9R0.34 CCC(C)NC(=O)CNC CSC000225638 [1,1,0,0,0,0|2,0,0]=4 18 B9R0.34 CCC(C)NC(=O)COC CSC000157950 [1,1,0,0,0,0|2,0,0]=4 19 B9R0.34 CCCC(=O)OC(C)CC CSC000062825 [1,1,0,0,0,0|1,0,0]=3 20 B9R0.34 CCOC(=O)CC(C)CC CSC011218107 [1,1,0,0,0,0|1,0,0]=3 21 B9R0.44 CCOC(=O)CC(C)(C)C CSC000170348 [1,1,0,0,0,0|1,0,0]=3 22 B9R0.44 CCOC(=O)CC(C)(F)F CSC000070698 [1,1,0,0,0,0|2,0,0]=4 23 B9R0.44 COCC(=O)NC(C)(C)C CSC000191696 [1,1,0,0,0,0|2,0,0]=4 24 B9R0.7 CC(C)CNC(=O)C(C)C CSC000171983 [1,1,0,0,0,0|1,0,1]=4 25 B9R0.7 CC(C)COC(=O)C(C)C CSC000005786 [1,1,0,0,0,0|1,0,1]=4 26 B9R0.56 CC(C)CNCC(C)(C)C CSC000688608 [1,1,0,0,0,0|1,0,0]=3 27 B9R0.10 CC(C)NC(=O)C(C)(C)C CSC000171935 [0,1,0,0,1,0|1,0,0]=3 28 B9R0.10 CC(C)NC(=O)C(C)(C)N CSC011440756 [0,1,0,0,1,0|1,0,0]=3 29 B9R0.42 CCC(C)NC(=O)C(C)C CSC000171953 [0,1,0,0,1,0|1,0,0]=3 30 B9R0.57 CC(C)C(=O)NC(C)(C)C CSC000171314 [0,1,0,0,1,0|1,0,0]=3 31 B11R0.34 CC(O)CNC(=O)OC(C)(C)C CSC000765332 [0,1,0,0,0,1|2,0,0]=4 32 B11R0.34 C[C@@H](O)CNC(=O)OC(C)(C)C CSC011830446 [0,1,0,0,0,1|2,0,0]=4 33 B11R0.34 C[C@H](O)CNC(=O)OC(C)(C)C CSC011934493 [0,1,0,0,0,1|2,0,0]=4 34 B11R0.51 CC(C)NC(=O)C(Br)C(C)(C)C CSC009814059 [0,2,0,0,0,0|1,0,0]=3 35 B11R0.119 C[C@@H](CO)NC(=O)OC(C)(C)C CSC011417613 [0,2,0,0,0,0|2,0,0]=4 36 B11R0.359 CC(C)(C)CC(=O)NC(C)(C)C CSC000171351 [0,2,0,0,0,0|1,0,0]=3 37 B11R0.359 CC(C)(C)NC(=O)NC(C)(C)C CSC000163412 [0,2,0,0,0,0|2,0,0]=4 38 B11R0.35 CC(C)CN(CCN)CC(C)C CSC011320166 [0,2,0,0,0,0|2,0,0]=4 39 B11R1.74 CC(C)N1C[C@H](C[C@H](C1)O)C [0,0,0,1,0,1|0,0,2]=4 40 B11R1.75 CC(C)CNC1CCC(C1)C CSC012091173 [0,0,0,1,0,1|1,0,1]=4 41 B11R1.75 CC(C)NCC1CCC(C1)C CSC012375525 [0,0,0,1,0,1|1,0,1]=4 42 B11R1.152 CN(C)CC(=O)N1CC(C1)F CSC015310996 [0,0,0,1,0,1|2,0,0]=4 43 B11R1.152 CN(C)CC(=O)N1CC(C1)O CSC012958789 [0,0,0,1,0,1|2,0,0]=4 44 B11R1.714 CC(C)CNC1CC(C1)(C)C CSC012737278 [0,0,0,1,0,1|1,0,1]=4 45 B11R1.43 CC(C)CN1CCC(C1)CN CSC000687041 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.43 CSC1CCN(C1)CC(C)C CSC046676452 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.157 CC(C)CN1CCOC(C1)C CSC046208235 [0,1,0,1,0,0|2,0,0]=4 48 B11R1.157 CC(C)CN1CCO[C@H](C1)C CSC015826093 [0,1,0,1,0,0|2,0,0]=4 49 B11R1.157 CC(C)CN1CCSC(C1)C CSC047798161 [0,1,0,1,0,0|2,0,0]=4 50 B11R1.413 COC1(CN(C1)CC(C)C)C CSC046228403 [0,1,0,1,0,0|2,0,0]=4 51 B9R0.48 CCCC(=O)OCC(C)C CSC000005790 [1,0,0,0,0,1|0,0,0]=2 52 B9R0.48 CCOC(=O)CCC(C)C CSC011212201 [1,0,0,0,0,1|1,0,0]=3 53 B9R0.48 CNCC(=O)NCC(C)C CSC000168150 [1,0,0,0,0,1|1,0,0]=3 54 B11R0.6 CC(C)CCOC(=O)CC(C)C CSC000024456 [0,0,0,0,0,2|0,0,0]=2