0 B27R3.5014071 CC(C(=O)CCOC1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100011211530 [0,0,0,0,0,0|4,0,0]=4 1 B27R3.5014071 CC(C(=O)NCCC1=CCCCC1)(c2ccccc2)c3ccccc3 11a_100000212019_100000752439 [0,0,0,0,0,0|3,0,1]=4 2 B27R3.5014071 CC(C(=O)NCCC1=CCCCC1)(c2ccccc2)c3ccccc3 1626a_100000212019_100000752439 [0,0,0,0,0,0|3,0,1]=4 3 B27R3.5014071 CC(C(=O)NCCC1=CCCCC1)(c2ccccc2)c3ccccc3 240690a_100000212019_100000752439 [0,0,0,0,0,0|3,0,1]=4 4 B27R3.5014071 CC(C(=O)NCCC1=CCCCC1)(c2ccccc2)c3ccccc3 527a_100000212019_100000752439 [0,0,0,0,0,0|3,0,1]=4 5 B27R3.5014071 CC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 11a_100000738074_100000752439 [0,0,0,0,0,0|3,0,0]=3 6 B27R3.5014071 CC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 1626a_100000738074_100000752439 [0,0,0,0,0,0|3,0,0]=3 7 B27R3.5014071 CC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 240690a_100000738074_100000752439 [0,0,0,0,0,0|3,0,0]=3 8 B27R3.5014071 CC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 527a_100000738074_100000752439 [0,0,0,0,0,0|3,0,0]=3 9 B26R3.4543748 O=C(CCOC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011211530 [1,0,0,0,0,0|3,0,0]=4 10 B26R2.965595 CCCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 11a_100000229939_100000752439 [0,0,1,0,0,0|3,0,0]=4 11 B26R2.965595 CCCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 1626a_100000229939_100000752439 [0,0,1,0,0,0|3,0,0]=4 12 B26R2.965595 CCCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 240690a_100000229939_100000752439 [0,0,1,0,0,0|3,0,0]=4 13 B26R2.965595 CCCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 527a_100000229939_100000752439 [0,0,1,0,0,0|3,0,0]=4 14 B28R4.647860741 CC1(c2ccccc2-c3c1cccc3)C(=O)NCCC4CCCCC4 1626a_100000738074_100015183572 [0,0,0,1,0,0|3,0,0]=4 15 B28R4.647860741 CC1(c2ccccc2-c3c1cccc3)C(=O)NCCC4CCCCC4 240690a_100000738074_100015183572 [0,0,0,1,0,0|3,0,0]=4 16 B28R4.647860741 CC1(c2ccccc2-c3c1cccc3)C(=O)NCCC4CCCCC4 527a_100000738074_100015183572 [0,0,0,1,0,0|3,0,0]=4 17 B28R4.647860741 O=C(CCCC1CCCCC1)C2(c3ccccc3-c4c2cccc4)O 1458a_100000056426_100011713725 [0,0,0,1,0,0|2,0,0]=3 18 B26R3.2074194 CC(C(=O)CCC1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100011273959 [0,0,0,0,1,0|2,0,0]=3 19 B26R3.39702471 CC(C(=O)CCCC1CCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100011713738 [0,0,0,0,1,0|3,0,0]=4 20 B28R3.5991427 CC(C(=O)NCCCC1CCCCC1)(c2ccccc2)c3ccccc3 11a_100011211642_100000752439 [0,0,0,0,0,1|3,0,0]=4 21 B28R3.5991427 CC(C(=O)NCCCC1CCCCC1)(c2ccccc2)c3ccccc3 1626a_100011211642_100000752439 [0,0,0,0,0,1|3,0,0]=4 22 B28R3.5991427 CC(C(=O)NCCCC1CCCCC1)(c2ccccc2)c3ccccc3 240690a_100011211642_100000752439 [0,0,0,0,0,1|3,0,0]=4 23 B28R3.5991427 CC(C(=O)NCCCC1CCCCC1)(c2ccccc2)c3ccccc3 527a_100011211642_100000752439 [0,0,0,0,0,1|3,0,0]=4 24 B28R3.61051685 CC(C(=O)NCCC1CCCCCC1)(c2ccccc2)c3ccccc3 11a_100011532351_100000752439 [0,0,0,0,0,1|3,0,0]=4 25 B28R3.61051685 CC(C(=O)NCCC1CCCCCC1)(c2ccccc2)c3ccccc3 1626a_100011532351_100000752439 [0,0,0,0,0,1|3,0,0]=4 26 B28R3.61051685 CC(C(=O)NCCC1CCCCCC1)(c2ccccc2)c3ccccc3 240690a_100011532351_100000752439 [0,0,0,0,0,1|3,0,0]=4 27 B28R3.61051685 CC(C(=O)NCCC1CCCCCC1)(c2ccccc2)c3ccccc3 527a_100011532351_100000752439 [0,0,0,0,0,1|3,0,0]=4 28 B25R2.148452 CCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 11a_100000229938_100000752439 [1,0,1,0,0,0|2,0,0]=4 29 B25R2.148452 CCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 1626a_100000229938_100000752439 [1,0,1,0,0,0|2,0,0]=4 30 B25R2.148452 CCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 240690a_100000229938_100000752439 [1,0,1,0,0,0|2,0,0]=4 31 B25R2.148452 CCCCCCCNC(=O)C(C)(c1ccccc1)c2ccccc2 527a_100000229938_100000752439 [1,0,1,0,0,0|2,0,0]=4 32 B25R2.1300013 CCCCCCCCNC(=O)C(c1ccccc1)c2ccccc2 11a_100000229939_100000210944 [1,0,1,0,0,0|2,0,0]=4 33 B25R2.1300013 CCCCCCCCNC(=O)C(c1ccccc1)c2ccccc2 1626a_100000229939_100000210944 [1,0,1,0,0,0|2,0,0]=4 34 B25R2.1300013 CCCCCCCCNC(=O)C(c1ccccc1)c2ccccc2 240690a_100000229939_100000210944 [1,0,1,0,0,0|2,0,0]=4 35 B25R2.1300013 CCCCCCCCNC(=O)C(c1ccccc1)c2ccccc2 527a_100000229939_100000210944 [1,0,1,0,0,0|2,0,0]=4 36 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 34a_100011215272_100011209188 [2,0,0,0,0,0|1,0,1]=4 37 B25R3.6854 c1ccc(cc1)C(COCCC2CCCCC2)c3ccccc3 7a_100011215272_100011273959 [2,0,0,0,0,0|1,0,1]=4 38 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100000211591_100000007876 [2,0,0,0,0,0|2,0,0]=4 39 B25R3.6854 c1ccc(cc1)C(SCCCN2CCCCC2)c3ccccc3 62a_100132302099_100011216954 [2,0,0,0,0,0|2,0,0]=4 40 B27R3.2804296 CC(CCC(=O)C(c1ccccc1)c2ccccc2)N3CCCCC3 1458a_100015185227_100011216954 [1,1,0,0,0,0|1,0,0]=3 41 B29R3.8069414 CCCC(C(=O)CCCN1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100020600600_100000690320 [0,2,0,0,0,0|2,0,0]=4 42 B29R3.8069414 CCOC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 11a_100000738074_100000684328 [0,2,0,0,0,0|2,0,0]=4 43 B29R3.8069414 CCOC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 1626a_100000738074_100000684328 [0,2,0,0,0,0|2,0,0]=4 44 B29R3.8069414 CCOC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 240690a_100000738074_100000684328 [0,2,0,0,0,0|2,0,0]=4 45 B29R3.8069414 CCOC(C(=O)NCCC1CCCCC1)(c2ccccc2)c3ccccc3 527a_100000738074_100000684328 [0,2,0,0,0,0|2,0,0]=4 46 B29R3.8069414 CCSC(C(=O)CCCN1CCCCC1)(c2ccccc2)c3ccccc3 1458a_200020658394_100000690320 [0,2,0,0,0,0|1,1,0]=4 47 B29R3.57343054 O=C(CCCN1CCCCC1)C(O)(c2ccccc2Cl)c3ccccc3Cl 1458a_200000057516_100000690320 [0,2,0,0,0,0|1,0,0]=3 48 B29R3.57343054 O=C(NCCC1CCCCC1)C(O)(c2ccccc2Cl)c3ccccc3Cl 240690a_100000738074_200000057516 [0,2,0,0,0,0|2,0,0]=4 49 B29R3.57343054 O=C(NCCC1CCCCC1)C(O)(c2ccccc2Cl)c3ccccc3Cl 527a_100000738074_200000057516 [0,2,0,0,0,0|2,0,0]=4 50 B27R3.311992690 CCCCCCCCCC(=O)C1(c2ccccc2-c3c1cccc3)O 1458a_100000056426_100000210670 [0,0,1,1,0,0|2,0,0]=4 51 B27R4.223967678 CC1(c2ccccc2-c3c1cccc3)C(=O)CCC4CCCCC4 1458a_100015183572_100011273959 [0,0,0,1,1,0|2,0,0]=4 52 B25R3.3975663 CC(OCCC1CCCCC1)(c2ccccc2)c3ccccc3 7a_100011202337_100011273959 [1,0,0,0,1,0|2,0,0]=4 53 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011273959 [1,0,0,0,1,0|1,0,0]=3 54 B25R3.2033538 O=C(CCC1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000211375_100011216954 [1,0,0,0,1,0|1,0,0]=3 55 B25R3.3975784 O=C(CCCC1CCCC1)C(c2ccccc2)c3ccccc3 1458a_100000210944_100011713738 [1,0,0,0,1,0|2,0,0]=4 56 B25R3.82776 CC(C(=O)CC1CCCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100000211423 [0,0,0,0,2,0|2,0,0]=4 57 B25R3.5535822 CC(C(=O)CCC1CCCC1)(c2ccccc2)c3ccccc3 1458a_100000752439_100000760354 [0,0,0,0,2,0|2,0,0]=4 58 B27R3.5013845 O=C(CCCCN1CCCCC1)C(c2ccccc2)c3ccccc3 1458a_100000754417_100011216954 [1,0,0,0,0,1|1,0,0]=3 59 B27R3.5013845 O=C(COCCC1CCCCC1)N(c2ccccc2)c3ccccc3 7a_100011217863_200015198546 [1,0,0,0,0,1|2,0,0]=4 60 B27R3.5013845 O=C(NCCCC1CCCCC1)C(c2ccccc2)c3ccccc3 11a_100011211642_100000210944 [1,0,0,0,0,1|2,0,0]=4 61 B27R3.5013845 O=C(NCCCC1CCCCC1)C(c2ccccc2)c3ccccc3 1626a_100011211642_100000210944 [1,0,0,0,0,1|2,0,0]=4 62 B27R3.5013845 O=C(NCCCC1CCCCC1)C(c2ccccc2)c3ccccc3 240690a_100011211642_100000210944 [1,0,0,0,0,1|2,0,0]=4 63 B27R3.5013845 O=C(NCCCC1CCCCC1)C(c2ccccc2)c3ccccc3 527a_100011211642_100000210944 [1,0,0,0,0,1|2,0,0]=4 64 B27R3.5014069 O=C(CCCN1CCCCC1)/C(=C/c2ccccc2)/c3ccccc3 1458a_100020600812_100000690320 [1,0,0,0,0,1|1,0,1]=4 65 B27R3.5014069 O=C(CCCN1CCCCC1)C(Sc2ccccc2)c3ccccc3 1458a_100005462441_100000690320 [1,0,0,0,0,1|1,0,0]=3 66 B27R3.5014069 O=C(NCCC1CCCCC1)C(Cc2ccccc2)c3ccccc3 11a_100000738074_200000261918 [1,0,0,0,0,1|2,0,0]=4 67 B27R3.5014069 O=C(NCCC1CCCCC1)C(Cc2ccccc2)c3ccccc3 1626a_100000738074_200000261918 [1,0,0,0,0,1|2,0,0]=4 68 B27R3.5014069 O=C(NCCC1CCCCC1)C(Cc2ccccc2)c3ccccc3 240690a_100000738074_200000261918 [1,0,0,0,0,1|2,0,0]=4 69 B27R3.5014069 O=C(NCCC1CCCCC1)C(Cc2ccccc2)c3ccccc3 527a_100000738074_200000261918 [1,0,0,0,0,1|2,0,0]=4 70 B27R3.5014069 O=C(NCCC1CCCCC1)C(Sc2ccccc2)c3ccccc3 11a_100000738074_100005462441 [1,0,0,0,0,1|2,0,0]=4 71 B27R3.5014069 O=C(NCCC1CCCCC1)C(Sc2ccccc2)c3ccccc3 1626a_100000738074_100005462441 [1,0,0,0,0,1|2,0,0]=4 72 B27R3.5014069 O=C(NCCC1CCCCC1)C(Sc2ccccc2)c3ccccc3 240690a_100000738074_100005462441 [1,0,0,0,0,1|2,0,0]=4 73 B27R3.5014069 O=C(NCCC1CCCCC1)C(Sc2ccccc2)c3ccccc3 527a_100000738074_100005462441 [1,0,0,0,0,1|2,0,0]=4 74 B27R3.5014106 O=C(CC(c1ccccc1)c2ccccc2)NCCC3CCCCC3 11a_100000738074_100000499737 [1,0,0,0,0,1|2,0,0]=4 75 B27R3.5014106 O=C(CC(c1ccccc1)c2ccccc2)NCCC3CCCCC3 1626a_100000738074_100000499737 [1,0,0,0,0,1|2,0,0]=4 76 B27R3.5014106 O=C(CC(c1ccccc1)c2ccccc2)NCCC3CCCCC3 240690a_100000738074_100000499737 [1,0,0,0,0,1|2,0,0]=4 77 B27R3.5014106 O=C(CC(c1ccccc1)c2ccccc2)NCCC3CCCCC3 527a_100000738074_100000499737 [1,0,0,0,0,1|2,0,0]=4 78 B27R3.5014106 O=C(CCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 11a_100000162943_100000211478 [1,0,0,0,0,1|2,0,0]=4 79 B27R3.5014106 O=C(CCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 1626a_100000162943_100000211478 [1,0,0,0,0,1|2,0,0]=4 80 B27R3.5014106 O=C(CCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 240690a_100000162943_100000211478 [1,0,0,0,0,1|2,0,0]=4 81 B27R3.5014106 O=C(CCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 527a_100000162943_100000211478 [1,0,0,0,0,1|2,0,0]=4 82 B27R3.5014106 O=C(CCCN1CCCCC1)CC(c2ccccc2)c3ccccc3 1458a_100000499737_100000690320 [1,0,0,0,0,1|1,0,0]=3 83 B27R3.5014106 O=C(NCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 2708a_100000738074_100000162943 [1,0,0,0,0,1|2,0,0]=4 84 B27R3.5014106 O=C(NCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 273464a_100000738074_100000162943 [1,0,0,0,0,1|2,0,0]=4 85 B27R3.5014106 O=C(NCCC1CCCCC1)NC(c2ccccc2)c3ccccc3 512a_100000738074_100000162943 [1,0,0,0,0,1|2,0,0]=4 86 B27R3.44114943 O=C(NCCC1CCCCCC1)C(c2ccccc2)c3ccccc3 11a_100011532351_100000210944 [1,0,0,0,0,1|2,0,0]=4 87 B27R3.44114943 O=C(NCCC1CCCCCC1)C(c2ccccc2)c3ccccc3 1626a_100011532351_100000210944 [1,0,0,0,0,1|2,0,0]=4 88 B27R3.44114943 O=C(NCCC1CCCCCC1)C(c2ccccc2)c3ccccc3 240690a_100011532351_100000210944 [1,0,0,0,0,1|2,0,0]=4 89 B27R3.44114943 O=C(NCCC1CCCCCC1)C(c2ccccc2)c3ccccc3 527a_100011532351_100000210944 [1,0,0,0,0,1|2,0,0]=4