0 B9R0.43 CCC(CC)COC(=O)C CSC000036730 [0,0,0,0,0,0|0,0,0]=0 1 B8R0.9 CC(CBr)COC(=O)C CSC009841261 [1,0,0,0,0,0|1,0,0]=2 2 B10R0.72 CCC(CC)NC(=O)C(=O)O CSC011297156 [0,1,0,0,0,0|3,0,0]=4 3 B10R1.31 CCC1CCN(C1)C(=O)N CSC012710758 [0,0,0,1,0,0|2,0,0]=3 4 B10R1.31 CCC1CCN(C1)C(C)C CSC047298775 [0,0,0,1,0,0|2,0,1]=4 5 B10R1.66 CC(=O)NCC1CCCN1 CSC011696608 [0,0,0,1,0,0|2,0,0]=3 6 B10R1.66 CC(=O)NCC1CCCO1 CSC000158280 [0,0,0,1,0,0|2,0,0]=3 7 B10R1.66 CC(=O)NCC1CCSC1 CSC014215000 [0,0,0,1,0,0|2,0,0]=3 8 B10R1.66 CC(=O)NN=C1CCCC1 CSC000004134 [0,0,0,1,0,0|2,0,1]=4 9 B10R1.66 CC(=O)OCC1CCCO1 CSC000006207 [0,0,0,1,0,0|1,0,0]=2 10 B10R1.66 CC(C)NCC1CCCC1 CSC011269212 [0,0,0,1,0,0|2,0,1]=4 11 B10R1.66 NC(=O)CCC1CCCC1 CSC000162258 [0,0,0,1,0,0|2,0,0]=3 12 B10R1.66 NC(=O)COC1CCCC1 CSC011347441 [0,0,0,1,0,0|3,0,0]=4 13 B10R1.173 CCC1CCC1NC(C)C CSC016159355 [0,0,0,1,0,0|2,0,1]=4 14 B10R0.77 CCN(CC)CCNC(=O)C CSC000158005 [0,0,0,0,0,1|2,0,0]=3 15 B9R0.24 CCC(C)CCC(=O)OC CSC000079262 [1,1,0,0,0,0|1,0,0]=3 16 B9R0.50 CCC(CC)NCCOC CSC000739274 [1,1,0,0,0,0|2,0,0]=4 17 B9R0.50 CCOCCN(CC)CC CSC000224614 [1,1,0,0,0,0|1,0,1]=4 18 B9R0.14 CCCC(CC)NC(=O)N CSC011593831 [0,1,0,0,1,0|2,0,0]=4 19 B9R0.52 CCC(CC)NS(=O)(=O)C CSC000169706 [0,1,0,0,1,0|2,0,0]=4 20 B11R0.200 CCN(CC)CCCC(=O)OC CSC011293842 [0,1,0,0,0,1|2,0,0]=4 21 B11R0.164 CCCCC(CC)CNC(=O)C CSC000191438 [0,2,0,0,0,0|1,0,0]=3 22 B11R0.164 CCCCC(CC)COC(=O)C CSC000031748 [0,2,0,0,0,0|0,0,0]=2 23 B11R0.9 CCCC(=O)OCC(CC)CC CSC000083641 [0,2,0,0,0,0|0,0,0]=2 24 B11R0.9 CCOC(=O)CCN(CC)CC CSC000177620 [0,2,0,0,0,0|2,0,0]=4 25 B9R1.13 CC(=O)NC1CCSC1 CSC012483018 [0,0,0,1,1,0|2,0,0]=4 26 B9R1.13 CS(=O)CC1CCCO1 CSC009859342 [0,0,0,1,1,0|2,0,0]=4 27 B11R1.3 CCN1CCN(CC1)C(=O)C CSC000158049 [0,0,0,1,0,1|2,0,0]=4 28 B11R1.37 CCC1COC(CN1CC)C CSC015273639 [0,1,0,1,0,0|1,0,1]=4 29 B11R1.57 CC(=O)NC1CCCC1CN CSC011781717 [0,1,0,1,0,0|2,0,0]=4 30 B11R1.57 CO[C@H]1COC[C@@H]1NC(=O)C [0,1,0,1,0,0|2,0,0]=4 31 B11R1.81 CCNC1CCC(=O)NC1C CSC015312158 [0,1,0,1,0,0|2,0,0]=4 32 B11R1.90 CC(=O)NCC1CCCC1O CSC012367623 [0,1,0,1,0,0|1,0,0]=3 33 B11R1.91 CC(=O)NCC1=CCCCC1 CSC010505009 [0,1,0,1,0,0|1,0,1]=4 34 B11R1.91 CC(=O)NCC1CCCCC1 CSC000159420 [0,1,0,1,0,0|1,0,0]=3 35 B11R1.91 CC(=O)NCC1CCCNC1 CSC011207013 [0,1,0,1,0,0|1,0,0]=3 36 B11R1.91 CC(=O)NCC1CCNCC1 CSC011206997 [0,1,0,1,0,0|1,0,0]=3 37 B11R1.91 CC(=O)OCC1CCCCC1 CSC000000618 [0,1,0,1,0,0|0,0,0]=2 38 B11R1.91 CC(=O)OCC1CCCCO1 CSC000006128 [0,1,0,1,0,0|0,0,0]=2 39 B11R1.91 NC(=O)CCC1CCCCC1 CSC000162346 [0,1,0,1,0,0|2,0,0]=4 40 B11R1.91 NC(=O)CCC1CCNCC1 CSC000695769 [0,1,0,1,0,0|2,0,0]=4 41 B11R1.91 NC(=O)NCC1CCCCO1 CSC011512277 [0,1,0,1,0,0|2,0,0]=4 42 B11R1.91 NC(=O)NCC1CCCSC1 CSC015335565 [0,1,0,1,0,0|2,0,0]=4 43 B11R1.91 NC(=O)NCC1CCSCC1 CSC011991091 [0,1,0,1,0,0|2,0,0]=4 44 B11R1.266 CCC1CC(CCO1)C(=O)N CSC015400545 [0,1,0,1,0,0|2,0,0]=4 45 B11R1.266 CNC1CCCN(C1)C(=O)C CSC011696133 [0,1,0,1,0,0|2,0,0]=4 46 B11R1.266 COC1CCCN(C1)C(=O)C CSC011809107 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.25 CCC(=O)NCC1CCCO1 CSC000158285 [0,1,0,1,0,0|2,0,0]=4 48 B11R1.25 CCC(=O)OCC1CCCO1 CSC000006213 [0,1,0,1,0,0|1,0,0]=3 49 B11R1.25 CNC(=O)NCC1CCCO1 CSC000235169 [0,1,0,1,0,0|2,0,0]=4 50 B11R1.25 NNC(=O)CCC1CCCC1 CSC000189796 [0,1,0,1,0,0|2,0,0]=4 51 B11R1.44 CCC(=O)N1CC[C@@H](C1)OC CSC015770736 [0,1,0,1,0,0|2,0,0]=4 52 B11R1.44 CNC(=O)N1CC[C@@H](C1)OC CSC015916964 [0,1,0,1,0,0|2,0,0]=4 53 B11R1.44 CO[C@H]1CCN(C1)C(=O)CN CSC015426919 [0,1,0,1,0,0|2,0,0]=4 54 B11R1.48 CCC1CN(CC1O)C(=O)C CSC015427157 [0,1,0,1,0,0|1,0,0]=3 55 B11R1.417 CCC1(CCN(C1)C(=O)C)O CSC016159373 [0,1,0,1,0,0|1,0,0]=3 56 B11R1.713 NC(=O)NCC1(CCCC1)O CSC011855633 [0,1,0,1,0,0|2,0,0]=4 57 B11R0.22 CCN(CC)CCCNC(=O)C CSC000161206 [0,0,0,0,0,2|2,0,0]=4