0 B15R1.155 CCCCN(c1ccnc(c1)C)C(C)C 27a_100000207398_100000758586 [0,0,1,0,0,0|2,0,1]=4 1 B15R1.882 CC1=CCC(CC1)C(C)NCCC(C)C 269862a_100000210545_100000073480 [0,0,1,0,0,0|1,0,2]=4 2 B15R1.882 CC1=CCC(CC1)C(C)NCCC(C)C 270004a_100000210545_100000073480 [0,0,1,0,0,0|1,0,2]=4 3 B15R1.882 CC1=CCN(CC1)C(C)CCCC(C)C 270004a_100000693516_100000753411 [0,0,1,0,0,0|1,0,1]=3 4 B15R1.882 CC1=CCN(CC1)C(C)CCOC(C)C 270004a_100000693516_200011219172 [0,0,1,0,0,0|2,0,1]=4 5 B15R1.882 Cc1ccc(cc1)C(C)NCCC(C)C 269862a_100000210545_100000185793 [0,0,1,0,0,0|1,0,2]=4 6 B15R1.882 Cc1ccc(cc1)C(C)OCCC(C)C 34a_100000210254_100011261388 [0,0,1,0,0,0|1,0,2]=4 7 B15R1.882 Cc1ccc(cc1)C(C)OCCC(C)C 7a_100000210254_100011261388 [0,0,1,0,0,0|1,0,2]=4 8 B15R1.882 Cc1ccc(cc1)C(C)SCCC(C)C 62a_100000210312_100011261388 [0,0,1,0,0,0|1,0,2]=4 9 B15R1.882 Cc1ccc(cc1)C(C)SCCC(C)C 62a_100011261388_100000210312 [0,0,1,0,0,0|1,0,2]=4 10 B15R1.882 Cc1ccc(cc1)N(C)CCCC(C)C 2230a_100000219977_100011214892 [0,0,1,0,0,0|1,0,2]=4 11 B15R1.882 Cc1ccc(cc1)N(C)CCCC(C)C 269982a_100000219977_100011214892 [0,0,1,0,0,0|1,0,2]=4 12 B15R1.882 Cc1ccc(cc1)N(C)CCCC(C)C 34a_100000219977_100011214892 [0,0,1,0,0,0|1,0,2]=4 13 B15R1.882 Cc1ccc(cc1)[C@@H](C)NCCC(C)C 2230a_100016988085_100000210312 [0,0,1,0,0,0|1,0,2]=4 14 B15R1.882 Cc1ccc(cc1)[C@@H](C)NCCC(C)C 269862a_100016988085_100000185833 [0,0,1,0,0,0|1,0,2]=4 15 B15R1.882 Cc1ccc(cc1)[C@@H](C)NCCC(C)C 34a_100016988085_100000210312 [0,0,1,0,0,0|1,0,2]=4 16 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(C)C 34a_100000690690_100000210312 [0,0,1,0,0,0|1,0,2]=4 17 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(C)C 7a_100000690690_100000210626 [0,0,1,0,0,0|1,0,2]=4 18 B15R1.882 Cc1ccc(cn1)C(C)NCCC(C)C 2230a_100011815741_100000210312 [0,0,1,0,0,0|2,0,1]=4 19 B15R1.882 Cc1ccc(cn1)C(C)NCCC(C)C 269862a_100000210545_100011280547 [0,0,1,0,0,0|2,0,1]=4 20 B15R1.882 Cc1ccc(cn1)C(C)NCCC(C)C 269862a_100011815741_100000185833 [0,0,1,0,0,0|2,0,1]=4 21 B15R1.882 Cc1ccc(cn1)C(C)NCCC(C)C 34a_100011815741_100000210312 [0,0,1,0,0,0|2,0,1]=4 22 B15R1.882 Cc1ccc(cn1)C(C)OCCC(C)C 34a_200011815720_100000210312 [0,0,1,0,0,0|2,0,1]=4 23 B15R1.882 Cc1ccc(cn1)C(C)OCCC(C)C 7a_200011815720_100000210626 [0,0,1,0,0,0|2,0,1]=4 24 B15R1.882 Cc1ccc(nc1)C(C)NCCC(C)C 269862a_100000210545_100000084104 [0,0,1,0,0,0|2,0,1]=4 25 B15R1.882 Cc1ccc(nc1)C(C)NCCC(C)C 270004a_100000210545_100000084104 [0,0,1,0,0,0|2,0,1]=4 26 B15R1.3805 CCc1cnc(cc1N(CC)C(C)C)C 27a_100000223864_100010291839 [0,0,1,0,0,0|2,0,1]=4 27 B14R1.2335 C=C(C)CCN1CC(CCC1C)CC 2230a_100011219223_100000730704 [1,0,1,0,0,0|1,0,1]=4 28 B14R1.2335 C=C(C)CCN1CC(CCC1C)CC 269982a_100011219223_100000730704 [1,0,1,0,0,0|1,0,1]=4 29 B14R1.2335 C=C(C)CCN1CC(CCC1C)CC 34a_100011219223_100000730704 [1,0,1,0,0,0|1,0,1]=4 30 B14R1.19 CCCCCC(C)N1CC=C(CC1)C 2230a_100000693516_200011218191 [1,0,1,0,0,0|1,0,1]=4 31 B14R1.19 CCCCCC(C)N1CC=C(CC1)C 269982a_100000693516_200011218191 [1,0,1,0,0,0|1,0,1]=4 32 B14R1.19 CCCCCC(C)N1CC=C(CC1)C 270004a_100000693516_100000211708 [1,0,1,0,0,0|1,0,1]=4 33 B14R1.19 CCCCCC(C)N1CC=C(CC1)C 34a_100000693516_200011218191 [1,0,1,0,0,0|1,0,1]=4 34 B14R1.420 CC(C)CCCC(C)N1CC=CCC1 270004a_100000698166_100000753411 [1,0,1,0,0,0|1,0,1]=4 35 B14R1.677 CC1=CCN(CC1)CCCCC(C)C 2230a_100000693516_100011216152 [1,0,1,0,0,0|1,0,1]=4 36 B14R1.677 CC1=CCN(CC1)CCCCC(C)C 269982a_100000693516_100011216152 [1,0,1,0,0,0|1,0,1]=4 37 B14R1.677 CC1=CCN(CC1)CCCCC(C)C 34a_100000693516_100011216152 [1,0,1,0,0,0|1,0,1]=4 38 B16R2.218827 C=C(C)CNC1CC2CC(C1C)C2(C)C 2230a_100000032975_100000748629 [0,0,1,1,0,0|1,0,1]=4 39 B16R2.218827 C=C(C)CNC1CC2CC(C1C)C2(C)C 34a_100000032975_100000748629 [0,0,1,1,0,0|1,0,1]=4 40 B16R2.218827 C=C(C)CO[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C 34a_100009816352_100000748629 [0,0,1,1,0,0|1,0,1]=4 41 B16R2.218827 C=C(C)CO[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C 7a_100009816352_100000748629 [0,0,1,1,0,0|1,0,1]=4 42 B16R2.402079 C=C(C)CNC1CC2CCC1(C2(C)C)C 2230a_100000716156_100000748629 [0,0,1,1,0,0|1,0,1]=4 43 B16R2.402079 C=C(C)CNC1CC2CCC1(C2(C)C)C 34a_100000716156_100000748629 [0,0,1,1,0,0|1,0,1]=4 44 B16R2.402079 C=C(C)CO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 34a_100000686805_100000748629 [0,0,1,1,0,0|1,0,1]=4 45 B16R2.402079 C=C(C)CO[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C 7a_100000686805_100000748629 [0,0,1,1,0,0|1,0,1]=4 46 B16R2.2868 CC1=CCN(CC1)C2CCCC(C2)(C)C 270004a_100000693516_100000031663 [0,0,1,1,0,0|1,0,1]=4 47 B14R1.678 CC1=CCN(CC1)C(C)CCC(C)C 2230a_100000693516_100011261404 [0,0,1,0,1,0|1,0,1]=4 48 B14R1.678 CC1=CCN(CC1)C(C)CCC(C)C 269982a_100000693516_100011261404 [0,0,1,0,1,0|1,0,1]=4 49 B14R1.678 CC1=CCN(CC1)C(C)CCC(C)C 270004a_100000693516_100000210476 [0,0,1,0,1,0|1,0,1]=4 50 B14R1.678 CC1=CCN(CC1)C(C)CCC(C)C 34a_100000693516_100011261404 [0,0,1,0,1,0|1,0,1]=4 51 B14R1.4268 Cc1cc(c[nH]1)C(C)NCCC(C)C 269862a_100000210545_100000133040 [0,0,1,0,1,0|2,0,0]=4 52 B14R1.4268 Cc1csc(c1)C(C)NCCC(C)C 269862a_100000210545_100000034720 [0,0,1,0,1,0|2,0,0]=4 53 B16R1.1026 CC1=CCC(CC1)C(C)NCCCC(C)C 269862a_200000737386_100000073480 [0,0,1,0,0,1|0,0,2]=4 54 B16R1.1026 CC1=CCC(CC1)C(C)NCCCC(C)C 270004a_200000737386_100000073480 [0,0,1,0,0,1|0,0,2]=4 55 B16R1.1026 CC1=CCN(CC1)C(C)CCOCC(C)C 270004a_100000693516_200011216429 [0,0,1,0,0,1|1,0,1]=4 56 B16R1.1026 Cc1ccc(cc1)C(C)NCCCC(C)C 2230a_200000737386_100011261388 [0,0,1,0,0,1|0,0,2]=4 57 B16R1.1026 Cc1ccc(cc1)C(C)NCCCC(C)C 269862a_200000737386_100000185793 [0,0,1,0,0,1|0,0,2]=4 58 B16R1.1026 Cc1ccc(cc1)C(C)NCCCC(C)C 34a_200000737386_100011261388 [0,0,1,0,0,1|0,0,2]=4 59 B16R1.1026 Cc1ccc(cc1)C(C)OCCCC(C)C 34a_100000210774_100011261388 [0,0,1,0,0,1|0,0,2]=4 60 B16R1.1026 Cc1ccc(cc1)C(C)OCCCC(C)C 7a_100000210774_100011261388 [0,0,1,0,0,1|0,0,2]=4 61 B16R1.1026 Cc1ccc(cc1)C(C)SCCCC(C)C 62a_100011214892_100011261388 [0,0,1,0,0,1|0,0,2]=4 62 B16R1.1026 Cc1ccc(cc1)C(C)SCCCC(C)C 62a_100011261388_100011214892 [0,0,1,0,0,1|0,0,2]=4 63 B16R1.1026 Cc1ccc(cc1)[C@@H](C)NCCCC(C)C 2230a_100016988085_100011214892 [0,0,1,0,0,1|0,0,2]=4 64 B16R1.1026 Cc1ccc(cc1)[C@@H](C)NCCCC(C)C 34a_100016988085_100011214892 [0,0,1,0,0,1|0,0,2]=4 65 B16R1.1026 Cc1ccc(cc1)[C@@H](C)OCCCC(C)C 34a_100000690690_100011214892 [0,0,1,0,0,1|0,0,2]=4 66 B16R1.1026 Cc1ccc(cc1)[C@@H](C)OCCCC(C)C 7a_100000690690_100011214892 [0,0,1,0,0,1|0,0,2]=4 67 B16R1.1026 Cc1ccc(cn1)C(C)NCCCC(C)C 2230a_100011815741_100011214892 [0,0,1,0,0,1|1,0,1]=4 68 B16R1.1026 Cc1ccc(cn1)C(C)NCCCC(C)C 269862a_200000737386_100011280547 [0,0,1,0,0,1|1,0,1]=4 69 B16R1.1026 Cc1ccc(cn1)C(C)NCCCC(C)C 34a_100011815741_100011214892 [0,0,1,0,0,1|1,0,1]=4 70 B16R1.1026 Cc1ccc(cn1)C(C)OCCCC(C)C 34a_200011815720_100011214892 [0,0,1,0,0,1|1,0,1]=4 71 B16R1.1026 Cc1ccc(cn1)C(C)OCCCC(C)C 7a_200011815720_100011214892 [0,0,1,0,0,1|1,0,1]=4 72 B16R1.1026 Cc1ccc(nc1)C(C)NCCCC(C)C 269862a_200000737386_100000084104 [0,0,1,0,0,1|1,0,1]=4 73 B16R1.1026 Cc1ccc(nc1)C(C)NCCCC(C)C 270004a_200000737386_100000084104 [0,0,1,0,0,1|1,0,1]=4 74 B16R1.1067 Cc1cnc(cn1)NC(C)CCCC(C)C 27a_100000210607_100000074397 [0,0,1,0,0,1|2,0,0]=4 75 B16R1.4317 CCc1cnc(cc1NC(CC)C(C)C)C 27a_100000745074_100010291839 [0,0,1,0,0,1|1,0,1]=4 76 B16R2.12129 Cc1ccc2c(c1)C(CCC2)NC(C)C 2230a_100015204190_100000210206 [1,0,0,0,0,1|0,0,2]=4 77 B16R2.12129 Cc1ccc2c(c1)C(CCC2)NC(C)C 34a_100015204190_100000210206 [1,0,0,0,0,1|0,0,2]=4 78 B13R0.1398 CC(=CCNC(C)CCCC(C)C)C 2230a_100000210607_100000761012 [1,0,2,0,0,0|1,0,0]=4 79 B13R0.1398 CC(=CCNC(C)CCCC(C)C)C 270004a_100000718196_100000753411 [1,0,2,0,0,0|1,0,0]=4 80 B13R0.1398 CC(=CCOC(C)CCCC(C)C)C 34a_200011218570_100000761012 [1,0,2,0,0,0|1,0,0]=4 81 B13R0.1398 CC(=CCOC(C)CCCC(C)C)C 7a_200011218570_100000761012 [1,0,2,0,0,0|1,0,0]=4 82 B13R0.139 CCCCCC(C)C(=O)CC=C(C)C 1458a_100011215998_100000761012 [1,0,2,0,0,0|1,0,0]=4 83 B13R0.139 CCCCCC(C)C(=O)CC=C(C)C 1458a_100011220947_200011218191 [1,0,2,0,0,0|1,0,0]=4 84 B13R0.182 CC(=CCC(=O)CCCCC(C)C)C 1458a_100011220947_100011216152 [1,0,2,0,0,0|1,0,0]=4 85 B13R0.182 CC(=CCC(=O)CCCCC(C)C)C 1458a_100011933920_100000761012 [1,0,2,0,0,0|1,0,0]=4 86 B13R1.337 CC(C)OCCCC1=CCC=CC1 34a_100020667889_100000210206 [2,0,1,0,0,0|1,0,0]=4 87 B15R1.38786 CC1=CCCC(C1/C=C/C(C)O[13CH3])(C)C 34a_100016267966_200025704644 [0,0,2,1,0,0|1,0,0]=4 88 B15R1.38786 CC1=CCCC(C1/C=C/C(C)O[13CH3])(C)C 7a_100016267966_200025704644 [0,0,2,1,0,0|1,0,0]=4 89 B15R1.38786 COC(C)/C=C/C1C(=CCCC1(C)C)C 34a_100016267966_200000210301 [0,0,2,1,0,0|1,0,0]=4 90 B15R1.38786 COC(C)/C=C/C1C(=CCCC1(C)C)C 7a_100016267966_200000210301 [0,0,2,1,0,0|1,0,0]=4 91 B17R2.469132 C=C(C)CC(=O)[C@@H]1C[C@@H]2C[C@H]([C@H]1C)C2(C)C 1458a_100034343844_100000748629 [0,1,1,1,0,0|0,0,1]=4 92 B13R0.349 CC(=CCC(=O)C(C)CCC(C)C)C 1458a_100011220947_100011261404 [0,0,2,0,1,0|1,0,0]=4 93 B13R0.1403 C=C(C)CN(C)C(C)CCCC(C)C 270004a_100000225649_100000753411 [0,0,2,0,1,0|1,0,0]=4 94 B13R1.97 C=C(C)CN1CC(CCC1C)CC 2230a_100011219223_100000748629 [1,0,1,0,1,0|1,0,0]=4 95 B13R1.97 C=C(C)CN1CC(CCC1C)CC 269982a_100011219223_100000748629 [1,0,1,0,1,0|1,0,0]=4 96 B13R1.97 C=C(C)CN1CC(CCC1C)CC 34a_100011219223_100000748629 [1,0,1,0,1,0|1,0,0]=4 97 B15R0.2724 CC(=CCC(=O)NC(C)CCCC(C)C)C 11a_100000210607_100011220947 [0,0,2,0,0,1|1,0,0]=4 98 B15R0.2724 CC(=CCC(=O)NC(C)CCCC(C)C)C 1626a_100000210607_100011220947 [0,0,2,0,0,1|1,0,0]=4 99 B15R0.2724 CC(=CCC(=O)NC(C)CCCC(C)C)C 240690a_100000210607_100011220947 [0,0,2,0,0,1|1,0,0]=4 100 B15R0.2724 CC(=CCC(=O)NC(C)CCCC(C)C)C 527a_100000210607_100011220947 [0,0,2,0,0,1|1,0,0]=4 101 B15R1.5483 Cc1cc(c[nH]1)C(C)NCCCC(C)C 269862a_200000737386_100000133040 [0,0,1,0,1,1|1,0,0]=4 102 B15R1.5483 Cc1csc(c1)C(C)NCCCC(C)C 269862a_200000737386_100000034720 [0,0,1,0,1,1|1,0,0]=4