0 B8R0.7 CCCCSCC(C)C CSC000018356 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.4 CC(C)CC(=O)OCC=C CSC000006416 [0,1,0,0,0,0|2,0,1]=4 2 B9R0.55 CC(=O)CCCOC(=O)C CSC000031019 [0,1,0,0,0,0|2,0,1]=4 3 B9R0.55 CC(C)OCCOC(=O)C CSC000006670 [0,1,0,0,0,0|2,0,0]=3 4 B9R0.55 CN(C)CCCNC(=O)C CSC000159965 [0,1,0,0,0,0|2,0,0]=3 5 B8R0.4 CCCCCCCSC CSC000033844 [1,1,0,0,0,0|0,1,1]=4 6 B8R0.4 CCCCCCSCC CSC000073868 [1,1,0,0,0,0|1,0,1]=4 7 B8R0.4 CCCCCSCCO CSC011215970 [1,1,0,0,0,0|0,0,2]=4 8 B8R0.4 CCCCSCCCC CSC000025195 [1,1,0,0,0,0|1,0,1]=4 9 B8R0.4 CSCCCCCCO CSC012179070 [1,1,0,0,0,0|0,0,2]=4 10 B8R0.4 CSCCCCCSC CSC009866234 [1,1,0,0,0,0|2,0,0]=4 11 B8R0.28 CC(C)CSCC(C)C CSC000031121 [1,1,0,0,0,0|1,0,1]=4 12 B10R0.98 CC(C)CCNC(=O)C(=O)N CSC000013945 [0,2,0,0,0,0|1,0,1]=4 13 B10R0.4 CC(C)NCCCCCCN CSC011419979 [0,2,0,0,0,0|1,0,1]=4 14 B10R0.55 CCC(=O)NCCCN(C)C CSC000159970 [0,2,0,0,0,0|2,0,0]=4 15 B10R0.97 CC(=O)NCCCCC(=O)O CSC011593336 [0,2,0,0,0,0|1,0,1]=4 16 B10R0.97 CC(C)CCSCCC(C)C CSC000043246 [0,2,0,0,0,0|1,0,1]=4 17 B10R0.97 CC(C)OCCCNC(=O)C CSC000161839 [0,2,0,0,0,0|1,0,0]=3 18 B10R0.96 CC(C)CC(=O)NCC(=O)O CSC000194594 [0,2,0,0,0,0|1,0,1]=4 19 B10R0.96 CC(C)NC(=O)CCC(=O)O CSC000199435 [0,2,0,0,0,0|1,0,1]=4 20 B10R0.96 CC(C)OC(=O)CCC(=O)C CSC000031084 [0,2,0,0,0,0|1,0,1]=4 21 B10R0.15 CC(=O)NCCSC(C)(C)C CSC016218394 [0,2,0,0,0,0|2,0,0]=4 22 B10R1.10 CC1CN(CCS1)CC=C CSC016025637 [0,1,0,1,0,0|2,0,0]=4 23 B10R1.10 CCCN1CCCC(C1)C CSC047234187 [0,1,0,1,0,0|1,0,1]=4 24 B10R1.10 CCNC1CCCC(C1)C CSC000201243 [0,1,0,1,0,0|1,0,1]=4 25 B10R1.16 CCCCN1CCC(C1)C CSC015424907 [0,1,0,1,0,0|1,0,1]=4 26 B10R1.16 CCCNC1CCC(C1)C CSC012090475 [0,1,0,1,0,0|1,0,1]=4 27 B10R1.16 CSCCN1CCC(C1)C CSC046509566 [0,1,0,1,0,0|2,0,0]=4 28 B10R1.18 CC(C)CN1CCCCC1 CSC000240348 [0,1,0,1,0,0|1,0,1]=4 29 B10R1.39 CCN1CCCC1C(C)C CSC015945522 [0,1,0,1,0,0|1,0,1]=4 30 B10R1.64 CC(C)CN1CCCC1C CSC046256365 [0,1,0,1,0,0|1,0,1]=4 31 B10R1.64 CC(C)NC1CCCC1C CSC011836758 [0,1,0,1,0,0|1,0,1]=4 32 B10R1.66 CC(C)CCN1CCCC1 CSC000224194 [0,1,0,1,0,0|1,0,1]=4 33 B10R1.66 CC(C)CSC1CCOC1 CSC047512326 [0,1,0,1,0,0|2,0,0]=4 34 B10R1.66 CC(C)NCC1CCCC1 CSC011269212 [0,1,0,1,0,0|1,0,1]=4 35 B10R1.66 CC(C)NCC1CCCO1 CSC000223896 [0,1,0,1,0,0|0,0,2]=4 36 B10R1.66 CC(C)SCC1CCCO1 CSC015450385 [0,1,0,1,0,0|0,0,2]=4 37 B10R1.141 CCCNC1CCC1(C)C CSC014782461 [0,1,0,1,0,0|1,0,1]=4 38 B10R1.162 CCN1CCCCC(C1)C CSC015250241 [0,1,0,1,0,0|1,0,1]=4 39 B10R1.173 CCC1CCC1NC(C)C CSC016159355 [0,1,0,1,0,0|1,0,1]=4 40 B10R1.348 CC(C)N1CCCCCC1 CSC000209149 [0,1,0,1,0,0|1,0,1]=4 41 B10R1.95 CSCC1CCC(O1)(C)C CSC015453650 [0,1,0,1,0,0|2,0,0]=4 42 B10R1.96 OCC1CCN(C1)CC=C CSC011652569 [0,1,0,1,0,0|2,0,0]=4 43 B10R1.149 CCN(C)C1CCNC1=O CSC047215055 [0,1,0,1,0,0|2,0,0]=4 44 B10R1.113 CC(=O)N1CCCC(C1)N CSC011448215 [0,1,0,1,0,0|2,0,0]=4 45 B10R1.113 CC(=O)N1CCCC(C1)O CSC011196156 [0,1,0,1,0,0|2,0,0]=4 46 B10R1.113 CC(=O)N1CCC[C@@H](C1)O CSC012179998 [0,1,0,1,0,0|2,0,0]=4 47 B10R1.113 CC(=O)N1CCC[C@H](C1)N CSC012662833 [0,1,0,1,0,0|2,0,0]=4 48 B10R1.113 CC(=O)N1CCC[C@H](C1)O CSC009851125 [0,1,0,1,0,0|2,0,0]=4 49 B10R1.113 CC1CCCN(C1)C(=O)C CSC000158579 [0,1,0,1,0,0|1,0,0]=3 50 B10R1.113 CC1CN(CCO1)C(=O)C CSC000243026 [0,1,0,1,0,0|2,0,0]=4 51 B10R1.113 CC1CN(CCS1)C(=O)N CSC011840667 [0,1,0,1,0,0|2,0,0]=4 52 B10R1.113 C[C@H]1CN(CCO1)C(=O)C CSC047888309 [0,1,0,1,0,0|2,0,0]=4 53 B10R1.361 CC(C)C1CCN1C(=O)N CSC015424837 [0,1,0,1,0,0|1,0,0]=3