0 B8R0.6 CCCSCC(=O)OC CSC000151543 [0,1,0,0,0,0|1,0,0]=2 1 B8R0.6 COC(=O)CCCSC CSC011216297 [0,1,0,0,0,0|1,0,0]=2 2 B8R0.6 COC(=O)CSCC#N CSC000151542 [0,1,0,0,0,0|2,0,1]=4 3 B8R0.6 COC(=O)CSCC=C CSC000151546 [0,1,0,0,0,0|1,0,2]=4 4 B8R0.7 CCCCSCC(=C)C CSC000026947 [0,1,0,0,0,0|2,0,0]=3 5 B8R0.7 CCCCSCC(C)C CSC000018356 [0,1,0,0,0,0|2,0,1]=4 6 B8R0.9 CC(CBr)COC(=O)C CSC009841261 [0,1,0,0,0,0|3,0,0]=4 7 B8R0.21 CCCCNS(=O)(=O)C CSC000169617 [0,1,0,0,0,0|2,0,1]=4 8 B8R0.21 CCCCNS(=O)(=O)N CSC011221735 [0,1,0,0,0,0|2,0,1]=4 9 B9R0.14 CCCC(CC)NC(=O)N CSC011593831 [0,2,0,0,0,0|2,0,0]=4 10 B9R0.34 CCCC(C)NC(=O)CC CSC000174104 [0,2,0,0,0,0|2,0,0]=4 11 B9R0.34 CCCC(C)NC(=O)OC CSC000236099 [0,2,0,0,0,0|1,0,0]=3 12 B9R0.34 CCCC(O)CC(=O)OC CSC000065524 [0,2,0,0,0,0|0,0,0]=2 13 B9R0.53 CC(CC(=O)O)NC(=O)C CSC000195607 [0,2,0,0,0,0|1,0,1]=4 14 B9R0.1 CCC(=O)NCCC(C)C CSC000159400 [0,2,0,0,0,0|2,0,0]=4 15 B9R0.1 COC(=O)CCCC(=O)C CSC000015542 [0,2,0,0,0,0|0,0,1]=3 16 B9R0.1 COC(=O)CSCC(=O)C CSC000151549 [0,2,0,0,0,0|1,0,1]=4 17 B9R0.1 COC(=O)CSCC(C)C CSC000151547 [0,2,0,0,0,0|1,0,0]=3 18 B9R0.5 CCCCCC(=O)OCC CSC000170156 [0,2,0,0,0,0|0,0,0]=2 19 B9R0.5 CCCCNC(=O)CNC CSC000213093 [0,2,0,0,0,0|2,0,0]=4 20 B9R0.5 CCCCNC(=O)COC CSC000159063 [0,2,0,0,0,0|1,0,0]=3 21 B9R0.5 CCCCNC(=O)NCC CSC000163430 [0,2,0,0,0,0|2,0,0]=4 22 B9R0.5 CCCCOC(=O)CCC CSC011212260 [0,2,0,0,0,0|2,0,0]=4 23 B9R0.5 CCOC(=O)CCCC#N CSC009871613 [0,2,0,0,0,0|1,0,1]=4 24 B9R0.5 COCCNC(=O)COC CSC000157859 [0,2,0,0,0,0|2,0,0]=4 25 B9R0.8 COC(=O)N(C)CCCN CSC000739217 [0,2,0,0,0,0|2,0,0]=4 26 B9R0.20 CCCCCS(=O)(=O)CC CSC009861012 [0,2,0,0,0,0|1,0,1]=4 27 B9R0.24 CCC(C)CCC(=O)OC CSC000079262 [0,2,0,0,0,0|0,0,0]=2 28 B9R0.46 CCC(=O)NCCCOC CSC000159236 [0,2,0,0,0,0|2,0,0]=4 29 B9R0.46 CCCCCCC(=O)NN CSC011221127 [0,2,0,0,0,0|1,0,0]=3 30 B9R0.46 CCCCCCC(=O)OC CSC011215249 [0,2,0,0,0,0|0,0,0]=2 31 B9R0.46 CCCCCNC(=O)CC CSC000157985 [0,2,0,0,0,0|1,0,0]=3 32 B9R0.46 CCCCCOC(=O)CC CSC000031694 [0,2,0,0,0,0|1,0,0]=3 33 B9R0.46 CCCCSCC(O)CO CSC011995958 [0,2,0,0,0,0|0,0,2]=4 34 B9R0.46 CNC(=O)NCCCOC CSC000235188 [0,2,0,0,0,0|2,0,0]=4 35 B9R0.46 COC(=O)CSCCC#N CSC000151555 [0,2,0,0,0,0|1,0,1]=4 36 B9R0.47 CCCCCC(=O)N(C)C CSC011216143 [0,2,0,0,0,0|1,0,0]=3 37 B9R0.47 CCCCNC(=O)C(=O)N CSC000124963 [0,2,0,0,0,0|1,0,1]=4 38 B9R0.47 CCCCNC(=O)C(C)C CSC000242797 [0,2,0,0,0,0|2,0,0]=4 39 B9R0.47 CCCCNC(=O)N(C)C CSC000178555 [0,2,0,0,0,0|2,0,0]=4 40 B9R0.47 CCCCOC(=O)C(C)C CSC011212254 [0,2,0,0,0,0|2,0,0]=4 41 B9R0.47 CNCCCN(C)C(=O)C CSC012025734 [0,2,0,0,0,0|2,0,0]=4 42 B9R0.2 CCC=CCCOC(=O)C CSC015190845 [0,2,0,0,0,0|1,0,1]=4 43 B9R0.2 CCCCCCCC(=O)N CSC011216093 [0,2,0,0,0,0|1,0,0]=3 44 B9R0.2 CCCCCCOC(=O)C CSC000032130 [0,2,0,0,0,0|1,0,0]=3 45 B9R0.2 CCOCCCNC(=O)C CSC000161218 [0,2,0,0,0,0|1,0,0]=3 46 B9R0.38 CCCCCNS(=O)(=O)C CSC000180709 [0,2,0,0,0,0|1,0,1]=4 47 B9R0.48 CCOC(=O)CCC(=O)C CSC011212338 [0,2,0,0,0,0|1,0,1]=4 48 B9R0.48 COCC(=O)NCC(=O)O CSC000194626 [0,2,0,0,0,0|1,0,1]=4 49 B9R0.55 CC(=O)CCCOC(=O)C CSC000031019 [0,2,0,0,0,0|1,0,1]=4 50 B9R0.55 CC(C)OCCOC(=O)C CSC000006670 [0,2,0,0,0,0|2,0,0]=4 51 B9R0.55 CN(C)CCCNC(=O)C CSC000159965 [0,2,0,0,0,0|2,0,0]=4 52 B9R0.7 CC(C)CNC(=O)C(=O)O CSC011297155 [0,2,0,0,0,0|1,0,1]=4 53 B9R0.7 CN(CCC(=O)O)C(=O)C CSC011216537 [0,2,0,0,0,0|1,0,1]=4 54 B9R0.42 CCC(C)NC(=O)C(=O)O CSC011297154 [0,2,0,0,0,0|1,0,1]=4 55 B9R0.43 CCC(CC)COC(=O)C CSC000036730 [0,2,0,0,0,0|2,0,0]=4 56 B9R1.13 CC(=O)NC1CCSC1 CSC012483018 [0,1,0,1,0,0|2,0,0]=4 57 B9R1.13 CS(=O)CC1CCCO1 CSC009859342 [0,1,0,1,0,0|2,0,0]=4 58 B9R1.11 CNC(=O)C1CCSC1 CSC012026102 [0,1,0,1,0,0|2,0,0]=4 59 B9R1.11 COC(=O)C1CCCS1 CSC012019181 [0,1,0,1,0,0|1,0,0]=3 60 B9R1.80 ClCC(=O)NCC1CC1 CSC000736049 [0,1,0,1,0,0|2,0,0]=4 61 B9R1.6 CC(=O)N1CCSCC1 CSC011323056 [0,1,0,1,0,0|2,0,0]=4 62 B9R1.6 NC(=O)C1CCSCC1 CSC000072764 [0,1,0,1,0,0|1,0,0]=3 63 B9R1.6 NC(=O)N1CCOCC1 CSC000189380 [0,1,0,1,0,0|2,0,0]=4 64 B9R1.24 CCN1CCCS1(=O)=O CSC020629780 [0,1,0,1,0,0|1,0,1]=4