0 B28R3.3889344072 CC(=O)c1ccc(cc1)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100000756337 [0,0,0,0,0,0|2,0,1]=3 1 B28R3.3889344072 CC(O)c1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 22a_100011216399_200000297812 [0,0,0,0,0,0|3,0,1]=4 2 B28R3.3889344072 CC(O)c1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 527a_100011216399_200000297812 [0,0,0,0,0,0|3,0,1]=4 3 B28R3.3889344072 CC1(CCC(c2c1ccc(c2)C(=O)Cc3ccc(cc3)[N+](=O)[O-])(C)C)C 1458a_200000297812_100000181861 [0,0,0,0,0,0|2,0,2]=4 4 B28R3.3889344072 CC1(CCC(c2c1ccc(c2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])(C)C)C 11a_100015195142_200000297812 [0,0,0,0,0,0|3,0,1]=4 5 B28R3.3889344072 CC1(CCC(c2c1ccc(c2)C(=O)Nc3ccc(cc3)[N+](=O)[O-])(C)C)C 1626a_100015195142_200000297812 [0,0,0,0,0,0|3,0,1]=4 6 B27R3.574485687 C=Cc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 11a_100011218248_200000297812 [1,0,0,0,0,0|3,0,0]=4 7 B27R3.574485687 C=Cc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1626a_100011218248_200000297812 [1,0,0,0,0,0|3,0,0]=4 8 B27R3.574485687 C=Cc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 22a_100011218248_200000297812 [1,0,0,0,0,0|3,0,0]=4 9 B27R3.574485687 C=Cc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 527a_100011218248_200000297812 [1,0,0,0,0,0|3,0,0]=4 10 B27R3.574485687 CC1(CCC(c2c1ccc(c2)C(=O)Cc3ccc(cc3)C=O)(C)C)C 1458a_200000297812_100000075337 [1,0,0,0,0,0|1,0,1]=3 11 B27R3.1508760074 CC(=O)c1ccc(cc1)CNc2ccc3c(c2)C(CCC3(C)C)(C)C 34a_100103148584_100000756337 [1,0,0,0,0,0|2,0,1]=4 12 B27R3.1508760074 CC(=O)c1ccc(cc1)CNc2ccc3c(c2)C(CCC3(C)C)(C)C 7a_100103148584_100000756337 [1,0,0,0,0,0|2,0,1]=4 13 B27R3.1508760074 CC(=O)c1ccc(cc1)COc2ccc3c(c2)C(CCC3(C)C)(C)C 34a_200009994325_100000756337 [1,0,0,0,0,0|2,0,1]=4 14 B27R3.1508760074 CC(=O)c1ccc(cc1)COc2ccc3c(c2)C(CCC3(C)C)(C)C 7a_200009994325_100000756337 [1,0,0,0,0,0|2,0,1]=4 15 B27R3.1508760074 CC1(CCC(c2c1ccc(c2)SCc3ccc(cc3)C(=O)N)(C)C)C 62a_100000231043_100011830464 [1,0,0,0,0,0|2,0,1]=4 16 B27R3.1508760074 CC1(CCC(c2c1ccc(c2)SCc3ccc(cc3)C(=O)N)(C)C)C 62a_100011830464_100000231043 [1,0,0,0,0,0|2,0,1]=4 17 B29R3.11865625792 COC(=O)c1ccc(cc1)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100000735637 [0,1,0,0,0,0|1,0,1]=3 18 B29R3.11865625792 COC(=O)c1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100016994500_200000297812 [0,1,0,0,0,0|2,0,0]=3 19 B29R3.16459693792 CC1(CCC(c2c1ccc(c2)C(=O)Nc3ccc(c(c3)Cl)C(=O)N)(C)C)C 11a_100000737725_200000297812 [0,1,0,0,0,0|3,0,0]=4 20 B29R3.16459693792 CC1(CCC(c2c1ccc(c2)C(=O)Nc3ccc(c(c3)Cl)C(=O)N)(C)C)C 1626a_100000737725_200000297812 [0,1,0,0,0,0|3,0,0]=4 21 B29R3.16459693792 CC1(CCC(c2c1ccc(c2)C(=O)Nc3ccc(c(c3)Cl)C(=O)N)(C)C)C 22a_100000737725_200000297812 [0,1,0,0,0,0|3,0,0]=4 22 B29R4.7582150512 CC1(CCC(c2c1ccc(c2)c3nc4ccc(cc4s3)C(=O)N)(C)C)C 271570a_200012352052_100010941663 [0,0,0,1,0,0|3,0,0]=4 23 B29R3.9916034604 CC(=O)c1ccc(cc1)OCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 34a_100000185113_100000409423 [0,0,0,0,0,1|2,0,1]=4 24 B29R3.9916034604 CC(=O)c1ccc(cc1)OCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 7a_100000185113_100000409423 [0,0,0,0,0,1|2,0,1]=4 25 B29R3.9916034604 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C(=O)N)(C)C)C 62a_100000162191_100000409423 [0,0,0,0,0,1|2,0,1]=4 26 B29R3.9916034604 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C(=O)N)(C)C)C 62a_100000409423_100000162191 [0,0,0,0,0,1|2,0,1]=4 27 B29R3.12386448384 CC(=O)Nc1ccc(cc1)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100000731167 [0,0,0,0,0,1|2,0,1]=4 28 B29R3.12386448384 CC(=O)Nc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 11a_100000184111_200000297812 [0,0,0,0,0,1|3,0,0]=4 29 B29R3.12386448384 CC(=O)Nc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1626a_100000184111_200000297812 [0,0,0,0,0,1|3,0,0]=4 30 B29R3.12386448384 CC(=O)Nc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 22a_100000184111_200000297812 [0,0,0,0,0,1|3,0,0]=4 31 B29R3.12386448384 CC(=O)Nc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 527a_100000184111_200000297812 [0,0,0,0,0,1|3,0,0]=4 32 B29R3.12386448384 CC(=O)Oc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 11a_100009829859_200000297812 [0,0,0,0,0,1|3,0,0]=4 33 B29R3.12386448384 CC(=O)Oc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1626a_100009829859_200000297812 [0,0,0,0,0,1|3,0,0]=4 34 B29R3.12386448384 CC(=O)Oc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 22a_100009829859_200000297812 [0,0,0,0,0,1|3,0,0]=4 35 B29R3.12386448384 CC(=O)Oc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 527a_100009829859_200000297812 [0,0,0,0,0,1|3,0,0]=4 36 B26R3.502806568 CC1(CCC(c2c1ccc(c2)NCc3ccc(cc3)C=O)(C)C)C 34a_100103148584_100009816848 [2,0,0,0,0,0|1,0,1]=4 37 B26R3.502806568 CC1(CCC(c2c1ccc(c2)NCc3ccc(cc3)C=O)(C)C)C 7a_100103148584_100009816848 [2,0,0,0,0,0|1,0,1]=4 38 B26R3.502806568 CC1(CCC(c2c1ccc(c2)OCc3ccc(cc3)C=O)(C)C)C 34a_200009994325_100009816848 [2,0,0,0,0,0|1,0,1]=4 39 B26R3.502806568 CC1(CCC(c2c1ccc(c2)OCc3ccc(cc3)C=O)(C)C)C 7a_200009994325_100009816848 [2,0,0,0,0,0|1,0,1]=4 40 B28R3.3026261975 CC1(CCC(c2c1ccc(c2)C(=O)Cc3ccc(c(c3)F)C=O)(C)C)C 1458a_200000297812_100010142638 [1,1,0,0,0,0|1,0,1]=4 41 B28R3.2428441815 COC(=O)c1ccc(cc1)C=Cc2ccc3c(c2)C(CCC3(C)C)(C)C 271570a_200010895429_100011830464 [1,1,0,0,0,0|0,0,0]=2 42 B28R3.2428441815 COC(=O)c1ccc(cc1)CNc2ccc3c(c2)C(CCC3(C)C)(C)C 270302a_100103148584_100000148700 [1,1,0,0,0,0|1,0,1]=4 43 B28R3.2428441815 COC(=O)c1ccc(cc1)CNc2ccc3c(c2)C(CCC3(C)C)(C)C 34a_100103148584_100000735637 [1,1,0,0,0,0|1,0,1]=4 44 B28R3.2428441815 COC(=O)c1ccc(cc1)CNc2ccc3c(c2)C(CCC3(C)C)(C)C 7a_100103148584_100000735637 [1,1,0,0,0,0|1,0,1]=4 45 B28R3.2428441815 COC(=O)c1ccc(cc1)COc2ccc3c(c2)C(CCC3(C)C)(C)C 34a_200009994325_100000735637 [1,1,0,0,0,0|1,0,1]=4 46 B28R3.2428441815 COC(=O)c1ccc(cc1)COc2ccc3c(c2)C(CCC3(C)C)(C)C 7a_200009994325_100000735637 [1,1,0,0,0,0|1,0,1]=4 47 B28R3.3889362316 CC(=O)c1ccc(cc1)C(=O)Nc2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000041050_200000210301 [1,1,0,0,0,0|2,0,0]=4 48 B28R3.3889362316 CC1(CCC(c2c1ccc(c2)NC(=O)c3ccc(cc3)C(=O)[13CH3])(C)C)C 1458a_200000041050_200025704644 [1,1,0,0,0,0|2,0,0]=4 49 B30R3.12252303678 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C(=O)CO)(C)C)C 62a_100000409423_100011219529 [0,1,0,0,0,1|1,0,1]=4 50 B30R3.12252303678 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C(=O)CO)(C)C)C 62a_100011219529_100000409423 [0,1,0,0,0,1|1,0,1]=4 51 B30R3.12252303678 COC(=O)c1ccc(cc1)CCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100010192280 [0,1,0,0,0,1|1,0,1]=4 52 B30R3.12252303678 COC(=O)c1ccc(cc1)OCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 34a_100000150123_100000409423 [0,1,0,0,0,1|1,0,1]=4 53 B30R3.12252303678 COC(=O)c1ccc(cc1)OCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 7a_100000150123_100000409423 [0,1,0,0,0,1|1,0,1]=4 54 B30R3.12252303678 COC(=O)c1ccc(cc1)SCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 62a_100000150774_100000409423 [0,1,0,0,0,1|1,0,1]=4 55 B30R3.12252303678 COC(=O)c1ccc(cc1)SCC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 62a_100000409423_100000150774 [0,1,0,0,0,1|1,0,1]=4 56 B30R3.12252873938 COC(=O)c1ccc(cc1)CC(=O)Nc2ccc3c(c2)C(CCC3(C)C)(C)C 11a_100103148584_100012277402 [0,1,0,0,0,1|1,0,1]=4 57 B30R3.12252873938 COC(=O)c1ccc(cc1)CC(=O)Nc2ccc3c(c2)C(CCC3(C)C)(C)C 1626a_100103148584_100012277402 [0,1,0,0,0,1|1,0,1]=4 58 B30R3.12252873938 COC(=O)c1ccc(cc1)CC(=O)Nc2ccc3c(c2)C(CCC3(C)C)(C)C 22a_100103148584_100012277402 [0,1,0,0,0,1|1,0,1]=4 59 B30R3.12252873938 COC(=O)c1ccc(cc1)CC(=O)Nc2ccc3c(c2)C(CCC3(C)C)(C)C 527a_100103148584_100012277402 [0,1,0,0,0,1|1,0,1]=4 60 B30R3.12252873938 COC(=O)c1ccc(cc1)CN(C)Cc2ccc3c(c2)C(CCC3(C)C)(C)C 26a_100000737656_200009994325 [0,1,0,0,0,1|1,0,1]=4 61 B30R3.13676203970 COC(=O)Cc1ccc(cc1)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100009816886 [0,1,0,0,0,1|1,0,1]=4 62 B30R3.13676203970 COC(=O)Cc1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000745640_200000297812 [0,1,0,0,0,1|2,0,0]=4 63 B30R3.11669193064 CCOC(=O)c1ccc(cc1)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100009812261 [0,2,0,0,0,0|1,0,1]=4 64 B30R3.11669193064 CCOC(=O)c1ccc(cc1)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000171572_200000297812 [0,2,0,0,0,0|2,0,0]=4 65 B30R3.12404757425 COC(=O)c1ccc(c(c1)C)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000746475_200000297812 [0,2,0,0,0,0|2,0,0]=4 66 B30R3.12404757425 COC(=O)c1ccc(c(c1)Cl)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100012194053 [0,2,0,0,0,0|1,0,1]=4 67 B30R3.12404757425 COC(=O)c1ccc(c(c1)F)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100000694138 [0,2,0,0,0,0|1,0,1]=4 68 B30R3.12404757425 COC(=O)c1ccc(c(c1)F)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000765761_200000297812 [0,2,0,0,0,0|2,0,0]=4 69 B30R3.17779006777 COC(=O)c1ccc(cc1Br)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100009998378_200000297812 [0,2,0,0,0,0|2,0,0]=4 70 B30R3.17779006777 COC(=O)c1ccc(cc1C)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100010991300 [0,2,0,0,0,0|1,0,1]=4 71 B30R3.17779006777 COC(=O)c1ccc(cc1C)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000751657_200000297812 [0,2,0,0,0,0|2,0,0]=4 72 B30R3.17779006777 COC(=O)c1ccc(cc1Cl)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100010128985 [0,2,0,0,0,0|1,0,1]=4 73 B30R3.17779006777 COC(=O)c1ccc(cc1Cl)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100000757510_200000297812 [0,2,0,0,0,0|2,0,0]=4 74 B30R3.17779006777 COC(=O)c1ccc(cc1F)CC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100000686969 [0,2,0,0,0,0|1,0,1]=4 75 B30R3.17779006777 COC(=O)c1ccc(cc1F)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100102713249_200000297812 [0,2,0,0,0,0|2,0,0]=4 76 B30R3.17779006777 COC(=O)c1ccc(cc1I)NC(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 188690a_100010150747_200000297812 [0,2,0,0,0,0|2,0,0]=4 77 B30R3.17779020265 COC(=O)c1ccc(cc1)C(C)C(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1458a_200000297812_100010159609 [0,2,0,0,0,0|1,0,1]=4 78 B30R3.17779020265 COC(=O)c1ccc(cc1)N(C)C(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 11a_100000220287_200000297812 [0,2,0,0,0,0|2,0,0]=4 79 B30R3.17779020265 COC(=O)c1ccc(cc1)N(C)C(=O)c2ccc3c(c2)C(CCC3(C)C)(C)C 1626a_100000220287_200000297812 [0,2,0,0,0,0|2,0,0]=4 80 B30R4.2451441966 COC(=O)c1ccc2[nH]c(cc2c1)c3ccc4c(c3)C(CCC4(C)C)(C)C 271570a_100010246281_100011830464 [0,1,0,1,0,0|1,0,1]=4 81 B30R4.2451441966 COC(=O)c1ccc2cc([nH]c2c1)c3ccc4c(c3)C(CCC4(C)C)(C)C 271570a_100010246268_100011830464 [0,1,0,1,0,0|1,0,0]=3 82 B26R3.2712427163 CC1(CCC(c2c1ccc(c2)Sc3ccc(cc3)C(=O)N)(C)C)C 62a_100000162191_100011830464 [1,0,0,0,1,0|2,0,0]=4 83 B26R3.2712427163 CC1(CCC(c2c1ccc(c2)Sc3ccc(cc3)C(=O)N)(C)C)C 62a_100011830464_100000162191 [1,0,0,0,1,0|2,0,0]=4 84 B28R3.1996083825 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C=O)(C)C)C 62a_100000188517_100000409423 [1,0,0,0,0,1|1,0,1]=4 85 B28R3.1996083825 CC1(CCC(c2c1ccc(c2)C(=O)CSc3ccc(cc3)C=O)(C)C)C 62a_100000409423_100000188517 [1,0,0,0,0,1|1,0,1]=4