0 B9R0.34 CCC(C)NC(=O)CNC CSC000225638 [0,0,0,0,0,0|3,0,0]=3 1 B9R0.34 CCC(C)NC(=O)COC CSC000157950 [0,0,0,0,0,0|3,0,0]=3 2 B9R0.34 CCCC(=O)OC(C)CC CSC000062825 [0,0,0,0,0,0|2,0,0]=2 3 B9R0.34 CCOC(=O)CC(C)CC CSC011218107 [0,0,0,0,0,0|0,0,0]=0 4 B8R0.1 CCCCS(=O)CCO CSC000117714 [1,0,0,0,0,0|3,0,0]=4 5 B8R0.1 CCOC(=O)CCSC CSC000173045 [1,0,0,0,0,0|1,0,0]=2 6 B8R0.1 CCOC(=O)CSCC CSC000172126 [1,0,0,0,0,0|1,0,0]=2 7 B10R0.2 CCCC(C)NC(=O)CNC CSC000225643 [0,1,0,0,0,0|3,0,0]=4 8 B10R0.2 CCCC(C)NC(=O)COC CSC000208403 [0,1,0,0,0,0|3,0,0]=4 9 B10R0.2 CCCC(O)CC(=O)OCC CSC011216533 [0,1,0,0,0,0|1,0,0]=2 10 B10R0.2 CCNC(=O)CC(=O)NCC CSC000076010 [0,1,0,0,0,0|2,0,1]=4 11 B10R0.2 COCC(C)NC(=O)COC CSC000161538 [0,1,0,0,0,0|3,0,0]=4 12 B10R0.7 CCC(C)(C)NC(=O)COC CSC000192546 [0,1,0,0,0,0|3,0,0]=4 13 B10R0.18 CCC(C)NC(=O)NCC=C CSC000048116 [0,1,0,0,0,0|2,0,1]=4 14 B10R0.18 CCCNC(=O)NC(C)CC CSC000163167 [0,1,0,0,0,0|2,0,0]=3 15 B10R0.26 CCOC(=O)CN(C)C(C)C CSC000227145 [0,1,0,0,0,0|1,0,0]=2 16 B10R0.26 COCC(=O)NC(C)C(C)C CSC000208441 [0,1,0,0,0,0|3,0,0]=4 17 B10R0.34 CCC(CC)NC(=O)COC CSC000161008 [0,1,0,0,0,0|3,0,0]=4 18 B10R0.34 CCOC(=O)CN(CC)CC CSC000224615 [0,1,0,0,0,0|1,0,0]=2 19 B10R0.46 CCC(C)NC(=O)C(=O)NC CSC015540854 [0,1,0,0,0,0|3,0,0]=4 20 B10R1.10 CCCN1CCCC(C1)C CSC047234187 [0,0,0,1,0,0|3,0,0]=4 21 B10R1.10 CCNC1CCCC(C1)C CSC000201243 [0,0,0,1,0,0|2,0,1]=4 22 B10R1.25 CCN1CC[C@H](C[C@H]1C)C [0,0,0,1,0,0|2,0,1]=4 23 B10R1.27 CCC(C)CN1CCCC1 CSC012721617 [0,0,0,1,0,0|3,0,0]=4 24 B10R1.96 CCCN1CCC(C1)CC CSC046395421 [0,0,0,1,0,0|3,0,0]=4 25 B10R1.131 CCCN1CC(C(C1)C)C CSC046148204 [0,0,0,1,0,0|3,0,0]=4 26 B10R1.134 CCC(C)NC(=O)C1CC1 CSC000157909 [0,0,0,1,0,0|2,0,0]=3 27 B10R1.137 CCNC(=O)NC1CCC1 CSC011910442 [0,0,0,1,0,0|2,0,0]=3 28 B10R1.137 CCOC(=O)CC1CCC1 CSC012001245 [0,0,0,1,0,0|0,0,0]=1 29 B10R1.149 CCN(C)C1CCNC1=O CSC047215055 [0,0,0,1,0,0|2,0,0]=3 30 B10R1.150 CCC(C)CN1CC(C1)C CSC016021867 [0,0,0,1,0,0|3,0,0]=4 31 B8R0.3 CCOC(=O)C(C)SC CSC000756453 [0,0,0,0,1,0|1,0,0]=2 32 B10R0.108 CCOC(=O)CNC(=O)CN CSC011367924 [0,0,0,0,0,1|2,0,1]=4 33 B10R0.108 CCOC(=O)NCC(=O)OC CSC000161429 [0,0,0,0,0,1|2,0,1]=4 34 B9R0.4 CCCCC(=O)OC(C)C CSC000169914 [1,1,0,0,0,0|0,0,0]=2 35 B9R0.4 CCCNC(=O)NC(C)C CSC000163085 [1,1,0,0,0,0|2,0,0]=4 36 B9R0.4 CCCOC(=O)CC(C)C CSC000170144 [1,1,0,0,0,0|2,0,0]=4 37 B9R0.4 CNCCC(=O)NC(C)C CSC011534604 [1,1,0,0,0,0|2,0,0]=4 38 B9R0.5 CCCC(=O)NCCSC CSC000161292 [1,1,0,0,0,0|2,0,0]=4 39 B9R0.5 CCCCCC(=O)OCC CSC000170156 [1,1,0,0,0,0|0,0,0]=2 40 B9R0.5 CCCCNC(=O)CNC CSC000213093 [1,1,0,0,0,0|2,0,0]=4 41 B9R0.5 CCCCNC(=O)COC CSC000159063 [1,1,0,0,0,0|2,0,0]=4 42 B9R0.5 CCCCNC(=O)NCC CSC000163430 [1,1,0,0,0,0|1,0,0]=3 43 B9R0.5 CCCCOC(=O)CCC CSC011212260 [1,1,0,0,0,0|1,0,0]=3 44 B9R0.5 CCNC(=O)NCCOC CSC000163157 [1,1,0,0,0,0|2,0,0]=4 45 B9R0.5 CCOC(=O)CCCC#N CSC009871613 [1,1,0,0,0,0|0,0,1]=3 46 B9R0.5 CCOC(=O)CSCC#N CSC000172129 [1,1,0,0,0,0|1,0,1]=4 47 B9R0.8 CCCOC(=O)C(C)CC CSC011213261 [1,1,0,0,0,0|2,0,0]=4 48 B9R0.18 CCCCC(=O)OCCC CSC000169915 [1,1,0,0,0,0|0,0,0]=2 49 B9R0.18 CCCCS(=O)CCCC CSC000031468 [1,1,0,0,0,0|2,0,0]=4 50 B9R0.18 CCCNC(=O)NCCC CSC000163711 [1,1,0,0,0,0|2,0,0]=4 51 B9R0.35 CCCC(C)C(=O)OCC CSC011217054 [1,1,0,0,0,0|0,0,0]=2 52 B9R0.48 CCCC(=O)OCC(C)C CSC000005790 [1,1,0,0,0,0|2,0,0]=4 53 B9R0.48 CCOC(=O)CCC(=O)C CSC011212338 [1,1,0,0,0,0|0,0,1]=3 54 B9R0.48 CCOC(=O)CCC(C)C CSC011212201 [1,1,0,0,0,0|0,0,0]=2 55 B9R0.44 CCOC(=O)CC(C)(C)C CSC000170348 [1,1,0,0,0,0|0,0,0]=2 56 B9R0.44 CCOC(=O)CC(C)(F)F CSC000070698 [1,1,0,0,0,0|1,0,0]=3 57 B9R0.44 CCOC(=O)CS(=O)(=O)C CSC011215758 [1,1,0,0,0,0|2,0,0]=4 58 B9R0.53 CC(C)CC(=O)NC(C)C CSC000157551 [1,1,0,0,0,0|1,0,0]=3 59 B9R0.53 CC(C)CC(=O)OC(C)C CSC000170143 [1,1,0,0,0,0|0,0,0]=2 60 B9R0.50 CCOCCN(CC)CC CSC000224614 [1,1,0,0,0,0|1,0,1]=4 61 B9R0.22 CCC(=O)NC(C)(C)CC CSC000174106 [1,1,0,0,0,0|1,0,0]=3 62 B9R0.22 CCC(C)NS(=O)(=O)CC CSC000169515 [1,1,0,0,0,0|2,0,0]=4 63 B9R0.26 CCC(CC)NC(=O)CC CSC000160997 [1,1,0,0,0,0|1,0,0]=3 64 B9R0.26 CCN(CC)CC(=O)OC CSC000224619 [1,1,0,0,0,0|1,0,0]=3 65 B9R0.42 CCC(=O)NC(C)C(C)C CSC011195746 [1,1,0,0,0,0|1,0,0]=3 66 B9R0.42 CCC(C)NC(=O)C(C)C CSC000171953 [1,1,0,0,0,0|1,0,0]=3 67 B9R0.42 COC(=O)NC(C)C(C)C CSC000236162 [1,1,0,0,0,0|1,0,0]=3 68 B9R0.19 CCOC(=O)C(C)(C)C#N CSC011216776 [0,1,0,0,1,0|1,0,1]=4 69 B9R0.19 CCOC(=O)C(C)(C)C=C CSC012186761 [0,1,0,0,1,0|0,0,2]=4 70 B9R0.19 CCOC(=O)C(C)(C)CO CSC011765865 [0,1,0,0,1,0|1,0,0]=3 71 B9R0.19 CCOC(=O)C(C)(C)SC CSC000036217 [0,1,0,0,1,0|1,0,0]=3 72 B9R0.37 CCCC(=O)N(CC)CC CSC000158721 [0,1,0,0,1,0|2,0,0]=4 73 B11R0.9 CCCC(=O)OCC(CC)CC CSC000083641 [0,1,0,0,0,1|1,0,0]=3 74 B11R0.9 CCOC(=O)CCN(CC)CC CSC000177620 [0,1,0,0,0,1|1,0,0]=3 75 B11R0.62 CCOC(=O)CNC(=O)OCC CSC011354237 [0,1,0,0,0,1|1,0,1]=4 76 B11R0.141 CCOC(=O)CCN(C)C(C)C CSC011277828 [0,1,0,0,0,1|1,0,0]=3 77 B11R0.1 CCOC(=O)CC(=O)NC(C)C CSC000058733 [0,2,0,0,0,0|1,0,1]=4 78 B11R0.5 CCCNC(=O)CC(=O)OCC CSC000058579 [0,2,0,0,0,0|1,0,1]=4 79 B11R0.5 CCCNC(=O)NC(C)CCC CSC000163701 [0,2,0,0,0,0|2,0,0]=4 80 B11R0.5 CCOC(=O)CN(C)CCOC CSC011408476 [0,2,0,0,0,0|1,0,0]=3 81 B11R0.72 CCCNC(=O)NC(CC)CC CSC000163652 [0,2,0,0,0,0|2,0,0]=4 82 B11R0.163 CCCNC(=O)NC(C)C(C)C CSC000163021 [0,2,0,0,0,0|2,0,0]=4 83 B11R0.54 CCOC(=O)CN(C)S(=O)(=O)C CSC011258064 [0,2,0,0,0,0|2,0,0]=4 84 B11R0.179 CCOC(=O)C(C)N(CC)CC CSC000216026 [0,2,0,0,0,0|1,0,0]=3 85 B11R0.119 C[C@@H](CO)NC(=O)OC(C)(C)C CSC011417613 [0,2,0,0,0,0|2,0,0]=4 86 B11R1.15 CC1CCN(C1)C(=O)CCN CSC011434084 [0,0,0,1,0,1|2,0,0]=4 87 B11R1.15 CCCC(=O)N1CCC(C1)N CSC011600442 [0,0,0,1,0,1|2,0,0]=4 88 B11R1.15 CCCC(=O)N1CC[C@@H](C1)N CSC012936781 [0,0,0,1,0,1|2,0,0]=4 89 B11R1.15 CCCC(=O)N1CC[C@@H](C1)O CSC012447290 [0,0,0,1,0,1|2,0,0]=4 90 B11R1.15 CCCC(=O)N1CC[C@H](C1)N CSC012926917 [0,0,0,1,0,1|2,0,0]=4 91 B11R1.15 CCCC(=O)N1CC[C@H](C1)O CSC012447084 [0,0,0,1,0,1|2,0,0]=4 92 B11R1.15 CCNC(=O)C1CCN(C1)C CSC015427873 [0,0,0,1,0,1|2,0,0]=4 93 B11R1.15 CCNC(=O)N1CCC(C1)N CSC000705615 [0,0,0,1,0,1|2,0,0]=4 94 B11R1.15 CCNC(=O)N1CC[C@@H](C1)N CSC012983631 [0,0,0,1,0,1|2,0,0]=4 95 B11R1.15 CCNC(=O)N1CC[C@H](C1)N CSC012983294 [0,0,0,1,0,1|2,0,0]=4 96 B11R1.23 CCC(C)N1CCC=C(C1)C CSC015324494 [0,0,0,1,0,1|2,0,0]=4 97 B11R1.23 CCC(C)N1CCC=C(C1)F CSC015351054 [0,0,0,1,0,1|2,0,0]=4 98 B11R1.23 CCC(C)N1CCOC(C1)C CSC015387323 [0,0,0,1,0,1|1,0,1]=4 99 B11R1.23 CCC(C)N1CCO[C@H](C1)C CSC015443214 [0,0,0,1,0,1|1,0,1]=4 100 B11R1.25 CCC(C)NCC1CCCO1 CSC000223433 [0,0,0,1,0,1|1,0,1]=4 101 B11R1.30 CCCC(=O)OC1CCCC1 CSC016221133 [0,1,0,1,0,0|2,0,0]=4 102 B11R1.30 CCNC(=O)NC1CCNC1 CSC000700497 [0,1,0,1,0,0|2,0,0]=4 103 B11R1.30 CCOC(=O)C=C1CCCC1 CSC000054197 [0,1,0,1,0,0|0,0,2]=4 104 B11R1.30 CCOC(=O)CC1CCCO1 CSC011219920 [0,1,0,1,0,0|0,0,0]=2 105 B11R1.30 CCOC(=O)CN1CCCC1 CSC000188105 [0,1,0,1,0,0|1,0,0]=3 106 B11R1.334 CCCC(C)NC(=O)C1CC1 CSC000172017 [0,1,0,1,0,0|2,0,0]=4 107 B11R1.334 COCC(C)NC(=O)C1CC1 CSC000161528 [0,1,0,1,0,0|2,0,0]=4 108 B11R1.284 CCCNC(=O)NC1CCC1 CSC011909585 [0,1,0,1,0,0|2,0,0]=4 109 B11R1.718 CC(C)C(C)NC(=O)C1CC1 CSC000208442 [0,1,0,1,0,0|2,0,0]=4 110 B11R1.367 CCC(CC)NC(=O)C1CC1 CSC000160998 [0,1,0,1,0,0|2,0,0]=4