0 B23R2.30458 CCC(C)COc1ccccc1C(=O)/C=C/c2ccccc2 7a_100016995325_100000748023 [0,0,0,0,0,0|2,0,2]=4 1 B23R2.30458 CC[C@H](C)COc1ccccc1C(=O)/C=C/c2ccccc2 7a_100016995325_100009816398 [0,0,0,0,0,0|2,0,2]=4 2 B22R2.29455 CCCCSc1ccccc1C(=O)CCc2ccccc2 1458a_200000217314_100000765856 [1,0,0,0,0,0|1,1,0]=3 3 B22R2.150128 CC(C)CSc1ccccc1C(=O)CCc2ccccc2 1458a_200000217235_100000765856 [1,0,0,0,0,0|1,1,0]=3 4 B24R2.30889 CCC(C)COc1ccccc1C(=O)OCc2ccc(cc2)Br 7a_100000751000_100000748023 [0,1,0,0,0,0|3,0,0]=4 5 B24R2.30889 CC[C@H](C)COc1ccccc1C(=O)OCc2ccc(cc2)Br 7a_100000751000_100009816398 [0,1,0,0,0,0|3,0,0]=4 6 B24R2.63470 CCCC(C)COc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_100011216630 [0,1,0,0,0,0|2,0,0]=3 7 B24R2.63470 CCCC(C)COc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100011216630 [0,1,0,0,0,0|2,0,0]=3 8 B24R2.731777 CCC(CC)COc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_100011215472 [0,1,0,0,0,0|2,0,0]=3 9 B24R2.731777 CCC(CC)COc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100011215472 [0,1,0,0,0,0|2,0,0]=3 10 B21R2.24809 CCCCOc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000230755 [2,0,0,0,0,0|1,0,1]=4 11 B21R2.24809 CCCCOc1ccccc1SCCc2ccccc2 62a_100000230755_100011218657 [2,0,0,0,0,0|2,0,0]=4 12 B21R2.24809 CCCCOc1ccccc1SCCc2ccccc2 62a_100000765856_100000230755 [2,0,0,0,0,0|2,0,0]=4 13 B21R2.22040 CCCSc1ccccc1C(=O)CCc2ccccc2 1458a_100000217225_100000765856 [2,0,0,0,0,0|0,1,0]=3 14 B21R2.22040 CC[Hg]Sc1ccccc1C(=O)CCc2ccccc2 1458a_100000046266_100000765856 [2,0,0,0,0,0|1,1,0]=4 15 B23R2.10118 CCCCCOc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_100000718602 [1,1,0,0,0,0|1,0,0]=3 16 B23R2.10118 CCCCCOc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100000210326 [1,1,0,0,0,0|1,0,0]=3 17 B23R2.32178 CCCCSc1ccccc1C(=O)C(C)Cc2ccccc2 1458a_200000217314_200011218536 [1,1,0,0,0,0|1,1,0]=4 18 B23R2.32210 CCCCOc1ccccc1C(=O)CCc2ccc(cc2)Br 1458a_100000215687_100011740612 [1,1,0,0,0,0|1,0,0]=3 19 B23R2.32210 CCCCOc1ccccc1C(=O)CCc2ccc(cc2)Cl 1458a_100000215687_100011713675 [1,1,0,0,0,0|1,0,0]=3 20 B23R2.32210 CCCCSc1ccccc1C(=O)CCc2ccc(cc2)C 1458a_200000217314_100011713686 [1,1,0,0,0,0|1,1,0]=4 21 B23R2.32210 CCCCSc1ccccc1C(=O)CCc2ccc(cc2)F 1458a_200000217314_100011217392 [1,1,0,0,0,0|1,1,0]=4 22 B23R2.32210 CCCCSc1ccccc1C(=O)CCc2ccc(cc2)O 1458a_200000217314_100009816426 [1,1,0,0,0,0|1,1,0]=4 23 B23R2.34604 CCCC(C)Oc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_100000766640 [1,1,0,0,0,0|1,0,0]=3 24 B23R2.34604 CCCC(C)Oc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100000766640 [1,1,0,0,0,0|1,0,0]=3 25 B23R2.486486 CCCCOc1ccccc1C(=O)CC(C)c2ccccc2 1458a_100000215687_100000756946 [1,1,0,0,0,0|1,0,0]=3 26 B23R2.486486 CCCCSc1ccccc1C(=O)CC(C)c2ccccc2 1458a_200000217314_100000756946 [1,1,0,0,0,0|1,1,0]=4 27 B23R2.486521 CCCCOc1ccccc1C(=O)CCc2cccc(c2)Br 1458a_100000215687_100011740638 [1,1,0,0,0,0|1,0,0]=3 28 B23R2.486521 CCCCOc1ccccc1C(=O)CCc2cccc(c2)Cl 1458a_100000215687_100011713710 [1,1,0,0,0,0|1,0,0]=3 29 B23R2.486521 CCCCSc1ccccc1C(=O)CCc2cccc(c2)C 1458a_200000217314_100011713685 [1,1,0,0,0,0|1,1,0]=4 30 B23R2.486521 CCCCSc1ccccc1C(=O)CCc2cccc(c2)F 1458a_200000217314_100011217235 [1,1,0,0,0,0|1,1,0]=4 31 B23R2.940555 CCCCOc1ccc(cc1C(=O)CCc2ccccc2)Br 1458a_200000217315_100000765856 [1,1,0,0,0,0|1,0,0]=3 32 B23R2.942715 CCCCOc1ccccc1C(=O)CCc2ccccc2Br 1458a_100000215687_100012161201 [1,1,0,0,0,0|1,0,0]=3 33 B23R2.942715 CCCCOc1ccccc1C(=O)CCc2ccccc2Cl 1458a_100000215687_100011713703 [1,1,0,0,0,0|1,0,0]=3 34 B23R2.942715 CCCCSc1ccccc1C(=O)CCc2ccccc2C 1458a_200000217314_100011713688 [1,1,0,0,0,0|1,1,0]=4 35 B23R2.942715 CCCCSc1ccccc1C(=O)CCc2ccccc2F 1458a_200000217314_100000720011 [1,1,0,0,0,0|1,1,0]=4 36 B23R2.942715 CCCCSc1ccccc1C(=O)CCc2ccccc2O 1458a_200000217314_100000722297 [1,1,0,0,0,0|1,1,0]=4 37 B23R2.25600 C=C(C)COc1ccccc1C(=O)CCc2ccc(cc2)Br 1458a_100000217157_100011740612 [1,1,0,0,0,0|1,0,1]=4 38 B23R2.25600 C=C(C)COc1ccccc1C(=O)CCc2ccc(cc2)Cl 1458a_100000217157_100011713675 [1,1,0,0,0,0|1,0,1]=4 39 B23R2.25600 CC(C)CSc1ccccc1C(=O)CCc2ccc(cc2)Cl 1458a_200000217235_100011713675 [1,1,0,0,0,0|1,1,0]=4 40 B23R2.25600 CC(C)CSc1ccccc1C(=O)CCc2ccc(cc2)F 1458a_200000217235_100011217392 [1,1,0,0,0,0|1,1,0]=4 41 B23R2.25600 Cc1ccc(cc1)CCC(=O)c2ccccc2SCC(C)C 1458a_200000217235_100011713686 [1,1,0,0,0,0|1,1,0]=4 42 B23R2.179663 C=C(C)COc1ccccc1C(=O)CCc2ccccc2Br 1458a_100000217157_100012161201 [1,1,0,0,0,0|1,0,1]=4 43 B23R2.179663 C=C(C)COc1ccccc1C(=O)CCc2ccccc2Cl 1458a_100000217157_100011713703 [1,1,0,0,0,0|1,0,1]=4 44 B23R2.179663 CC(C)CSc1ccccc1C(=O)CCc2ccccc2Cl 1458a_200000217235_100011713703 [1,1,0,0,0,0|1,1,0]=4 45 B23R2.179663 CC(C)CSc1ccccc1C(=O)CCc2ccccc2F 1458a_200000217235_100000720011 [1,1,0,0,0,0|1,1,0]=4 46 B23R2.179663 Cc1ccccc1CCC(=O)c2ccccc2SCC(C)C 1458a_200000217235_100011713688 [1,1,0,0,0,0|1,1,0]=4 47 B23R2.186888 CC(C)CSc1ccccc1C(=O)C(C)Cc2ccccc2 1458a_200000217235_200011218536 [1,1,0,0,0,0|1,1,0]=4 48 B23R2.392448 C=C(C)COc1ccccc1C(=O)CCc2cccc(c2)Br 1458a_100000217157_100011740638 [1,1,0,0,0,0|1,0,1]=4 49 B23R2.392448 C=C(C)COc1ccccc1C(=O)CCc2cccc(c2)Cl 1458a_100000217157_100011713710 [1,1,0,0,0,0|1,0,1]=4 50 B23R2.392448 CC(C)CSc1ccccc1C(=O)CCc2cccc(c2)Cl 1458a_200000217235_100011713710 [1,1,0,0,0,0|1,1,0]=4 51 B23R2.392448 CC(C)CSc1ccccc1C(=O)CCc2cccc(c2)F 1458a_200000217235_100011217235 [1,1,0,0,0,0|1,1,0]=4 52 B23R2.392448 Cc1cccc(c1)CCC(=O)c2ccccc2SCC(C)C 1458a_200000217235_100011713685 [1,1,0,0,0,0|1,1,0]=4 53 B23R2.467769 C=C(C)COc1ccccc1C(=O)CC(C)c2ccccc2 1458a_100000217157_100000756946 [1,1,0,0,0,0|1,0,1]=4 54 B23R2.467769 CC(C)CSc1ccccc1C(=O)CC(C)c2ccccc2 1458a_200000217235_100000756946 [1,1,0,0,0,0|1,1,0]=4 55 B23R2.173274 CCC(CC)Oc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100000210505 [0,1,0,0,1,0|2,0,0]=4 56 B23R2.346283 CCC(C)(C)Oc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_100000210677 [0,1,0,0,1,0|2,0,0]=4 57 B25R2.1261906 CCC(C)COc1ccc(cc1NC(=O)CCc2ccccc2)Cl 34a_200046153370_100000748023 [0,1,0,0,0,1|2,0,0]=4 58 B25R2.1261906 CCC(C)COc1ccc(cc1NC(=O)CCc2ccccc2)Cl 7a_200046153370_100000748023 [0,1,0,0,0,1|2,0,0]=4 59 B25R2.1261906 CC[C@H](C)COc1ccc(cc1NC(=O)CCc2ccccc2)Cl 34a_200046153370_100009816398 [0,1,0,0,0,1|2,0,0]=4 60 B25R2.1261906 CC[C@H](C)COc1ccc(cc1NC(=O)CCc2ccccc2)Cl 7a_200046153370_100009816398 [0,1,0,0,0,1|2,0,0]=4 61 B25R3.2033308 O=C(CCc1ccccc1)c2ccccc2OCC3CCCC3 34a_100000620706_100000740388 [0,1,0,1,0,0|2,0,0]=4 62 B25R3.2033308 O=C(CCc1ccccc1)c2ccccc2OCC3CCCC3 7a_100000620706_100000740388 [0,1,0,1,0,0|2,0,0]=4 63 B25R3.59846641 CC1(CCC1)COc2ccccc2C(=O)CCc3ccccc3 34a_100000620706_100000726658 [0,1,0,1,0,0|2,0,0]=4 64 B25R3.59846641 CC1(CCC1)COc2ccccc2C(=O)CCc3ccccc3 7a_100000620706_100000726658 [0,1,0,1,0,0|2,0,0]=4 65 B21R2.24807 CCCCSc1ccccc1C(=O)Cc2ccccc2 1458a_200000217314_100015291786 [1,0,0,0,1,0|1,1,0]=4 66 B21R2.22510 CC(C)Sc1ccccc1C(=O)CCc2ccccc2 1458a_100000229993_100000765856 [1,0,0,0,1,0|1,1,0]=4 67 B23R2.486522 CCCCOc1ccccc1C(=O)C/C=C/c2ccccc2 1458a_100000215687_100016265936 [1,0,0,0,0,1|1,0,1]=4 68 B23R2.486522 CCCCOc1ccccc1C(=O)CCCc2ccccc2 1458a_100000215687_100000211621 [1,0,0,0,0,1|1,0,0]=3 69 B23R2.486522 CCCCOc1ccccc1C(=O)CCSc2ccccc2 1458a_100000215687_100000246102 [1,0,0,0,0,1|1,0,0]=3 70 B23R2.486522 CCCCSc1ccccc1C(=O)CCCc2ccccc2 1458a_200000217314_100000211621 [1,0,0,0,0,1|1,1,0]=4 71 B23R2.486522 CCCCSc1ccccc1C(=O)CCOc2ccccc2 1458a_200000217314_100000184471 [1,0,0,0,0,1|1,1,0]=4 72 B23R2.486522 CCCCSc1ccccc1C(=O)CCSc2ccccc2 1458a_200000217314_100000246102 [1,0,0,0,0,1|1,1,0]=4 73 B23R2.486522 CCCCSc1ccccc1C(=O)CSCc2ccccc2 1458a_200000217314_200011217039 [1,0,0,0,0,1|1,1,0]=4 74 B23R2.467780 C=C(C)COc1ccccc1C(=O)CCSc2ccccc2 1458a_100000217157_100000246102 [1,0,0,0,0,1|1,0,1]=4 75 B23R2.467780 CC(C)CSc1ccccc1C(=O)CCCc2ccccc2 1458a_200000217235_100000211621 [1,0,0,0,0,1|1,1,0]=4 76 B23R2.467780 CC(C)CSc1ccccc1C(=O)CCOc2ccccc2 1458a_200000217235_100000184471 [1,0,0,0,0,1|1,1,0]=4 77 B23R2.467780 CC(C)CSc1ccccc1C(=O)CCSc2ccccc2 1458a_200000217235_100000246102 [1,0,0,0,0,1|1,1,0]=4 78 B23R2.467780 CC(C)CSc1ccccc1C(=O)CSCc2ccccc2 1458a_200000217235_200011217039 [1,0,0,0,0,1|1,1,0]=4