0 B27R3.6309973 CC(CNC(=O)N(C)Cc1cccc2c1cc[nH]2)c3ccc(cc3)O 2708a_200015188644_100000719444 [0,0,0,0,0,0|4,0,0]=4 1 B27R3.6309973 CC(CNC(=O)N(C)Cc1cccc2c1cc[nH]2)c3ccc(cc3)O 273464a_200015188644_100000719444 [0,0,0,0,0,0|4,0,0]=4 2 B27R3.6309973 CN(Cc1cccc2c1cc[nH]2)C(=O)NCC(O)c3ccc(cc3)Br 273464a_100020626992_100000719444 [0,0,0,0,0,0|4,0,0]=4 3 B27R3.6309973 Cc1ccc(cc1)C(O)CNC(=O)N(C)Cc2cccc3c2cc[nH]3 273464a_200020610344_100000719444 [0,0,0,0,0,0|4,0,0]=4 4 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 2708a_100011912549_200015188644 [1,0,0,0,0,0|3,0,0]=4 5 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 2708a_200015188644_100011912549 [1,0,0,0,0,0|3,0,0]=4 6 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 273464a_100011912549_200015188644 [1,0,0,0,0,0|3,0,0]=4 7 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 273464a_200015188644_100011912549 [1,0,0,0,0,0|3,0,0]=4 8 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 512a_100011912549_200015188644 [1,0,0,0,0,0|3,0,0]=4 9 B26R3.396248 CC(CNC(=O)NCc1cccc2c1cc[nH]2)c3ccc(cc3)O 512a_200015188644_100011912549 [1,0,0,0,0,0|3,0,0]=4 10 B26R3.396248 Cc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 2708a_100011912549_200020610344 [1,0,0,0,0,0|3,0,0]=4 11 B26R3.396248 Cc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 273464a_100011912549_200020610344 [1,0,0,0,0,0|3,0,0]=4 12 B26R3.396248 Cc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 273464a_200020610344_100011912549 [1,0,0,0,0,0|3,0,0]=4 13 B26R3.396248 Cc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 512a_100011912549_200020610344 [1,0,0,0,0,0|3,0,0]=4 14 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 2708a_100011912549_100020626992 [1,0,0,0,0,0|3,0,0]=4 15 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 273464a_100011912549_100020626992 [1,0,0,0,0,0|3,0,0]=4 16 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 273464a_100020626992_100011912549 [1,0,0,0,0,0|3,0,0]=4 17 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 512a_100011912549_100020626992 [1,0,0,0,0,0|3,0,0]=4 18 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 512a_100020626992_100011912549 [1,0,0,0,0,0|3,0,0]=4 19 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 2708a_100011912549_100000736658 [1,0,0,0,0,0|3,0,0]=4 20 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 273464a_100011912549_100000736658 [1,0,0,0,0,0|3,0,0]=4 21 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 512a_100000736658_100011912549 [1,0,0,0,0,0|3,0,0]=4 22 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 512a_100011912549_100000736658 [1,0,0,0,0,0|3,0,0]=4 23 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 2708a_100011912549_100000067596 [1,0,0,0,0,0|2,0,0]=3 24 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 273464a_100011912549_100000067596 [1,0,0,0,0,0|2,0,0]=3 25 B26R3.396248 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 512a_100011912549_100000067596 [1,0,0,0,0,0|2,0,0]=3 26 B26R3.396248 O=C(NCc1cccc2c1cn[nH]2)NCC(O)c3ccc(cc3)O 2708a_100000099548_100000067596 [1,0,0,0,0,0|3,0,0]=4 27 B26R3.396248 O=C(NCc1cccc2c1cn[nH]2)NCC(O)c3ccc(cc3)O 273464a_100000099548_100000067596 [1,0,0,0,0,0|3,0,0]=4 28 B26R3.396248 O=C(NCc1cccc2c1cn[nH]2)NCC(O)c3ccc(cc3)O 512a_100000099548_100000067596 [1,0,0,0,0,0|3,0,0]=4 29 B26R3.396248 O=C(NCc1ccnc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 2708a_100025756391_100000067596 [1,0,0,0,0,0|3,0,0]=4 30 B26R3.396248 O=C(NCc1ccnc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 273464a_100025756391_100000067596 [1,0,0,0,0,0|3,0,0]=4 31 B26R3.396248 O=C(NCc1ccnc2c1cc[nH]2)NCC(O)c3ccc(cc3)O 512a_100025756391_100000067596 [1,0,0,0,0,0|3,0,0]=4 32 B26R3.2734398 CN(Cc1cccc2c1cc[nH]2)C(=O)NCCc3ccc(cc3)O 2708a_100000743037_100000719444 [1,0,0,0,0,0|3,0,0]=4 33 B26R3.2734398 CN(Cc1cccc2c1cc[nH]2)C(=O)NCCc3ccc(cc3)O 273464a_100000743037_100000719444 [1,0,0,0,0,0|3,0,0]=4 34 B26R3.39752430 CN(CCC(O)c1ccccc1)C(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100011218556 [1,0,0,0,0,0|3,0,0]=4 35 B26R3.39752430 CN(Cc1cccc2c1cc[nH]2)C(=O)NCC(O)c3ccccc3 273464a_100000210709_100000719444 [1,0,0,0,0,0|3,0,0]=4 36 B28R3.83722382 CN(Cc1cccc2c1cc[nH]2)C(=O)NCC(O)c3ccc(c(c3)O)O 273464a_100000106456_100000719444 [0,1,0,0,0,0|3,0,0]=4 37 B26R3.395196 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100016988945 [0,0,0,0,1,0|2,0,0]=3 38 B26R3.395196 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cccc3c2ccs3 2430a_100020628958_100016988945 [0,0,0,0,1,0|3,0,0]=4 39 B25R2.117995 COc1cccc(c1)NC(=O)C(=O)NCC(O)c2ccc(cc2)O 240690a_100000067596_200011297338 [1,0,1,0,0,0|1,0,1]=4 40 B25R2.1197983 Cc1cccc(c1C)NC(=O)C(=O)NCC(O)c2ccc(cc2)O 240690a_100000067596_200011297339 [1,0,1,0,0,0|0,0,2]=4 41 B25R2.1465217 CCc1ccccc1NC(=O)C(=O)NCC(O)c2ccc(cc2)O 240690a_100000067596_200011297324 [1,0,1,0,0,0|0,0,2]=4 42 B25R2.1465217 COc1ccccc1NC(=O)C(=O)NCC(O)c2ccc(cc2)O 240690a_100000067596_200011297187 [1,0,1,0,0,0|1,0,1]=4 43 B25R3.746318 O=C(CCCCc1ccc(cc1)O)Nc2cccc3c2cc[nH]3 22a_100011218720_100000047048 [2,0,0,0,0,0|1,0,1]=4 44 B25R3.746318 O=C(CCCCc1ccc(cc1)O)Nc2cccc3c2cc[nH]3 527a_100011218720_100000047048 [2,0,0,0,0,0|1,0,1]=4 45 B25R3.3978597 O=C(NCCC(O)c1ccccc1)Nc2cccc3c2cc[nH]3 2430a_100011218720_100000763605 [2,0,0,0,0,0|2,0,0]=4 46 B25R3.746387 O=C(NCCc1ccc(cc1)O)NCc2cccc3c2cc[nH]3 2708a_100000743037_100011912549 [2,0,0,0,0,0|2,0,0]=4 47 B25R3.746387 O=C(NCCc1ccc(cc1)O)NCc2cccc3c2cc[nH]3 2708a_100011912549_100000743037 [2,0,0,0,0,0|2,0,0]=4 48 B25R3.746387 O=C(NCCc1ccc(cc1)O)NCc2cccc3c2cc[nH]3 273464a_100000743037_100011912549 [2,0,0,0,0,0|2,0,0]=4 49 B25R3.746387 O=C(NCCc1ccc(cc1)O)NCc2cccc3c2cc[nH]3 273464a_100011912549_100000743037 [2,0,0,0,0,0|2,0,0]=4 50 B25R3.746387 O=C(NCCc1ccc(cc1)O)NCc2cccc3c2cc[nH]3 512a_100011912549_100000743037 [2,0,0,0,0,0|2,0,0]=4 51 B25R3.32609167 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccccc3 2708a_100011912549_100000210709 [2,0,0,0,0,0|2,0,0]=4 52 B25R3.32609167 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccccc3 273464a_100000210709_100011912549 [2,0,0,0,0,0|2,0,0]=4 53 B25R3.32609167 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccccc3 273464a_100011912549_100000210709 [2,0,0,0,0,0|2,0,0]=4 54 B25R3.32609167 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccccc3 512a_100011912549_100000210709 [2,0,0,0,0,0|2,0,0]=4 55 B27R3.3409116 COc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 2708a_100011912549_100000738651 [1,1,0,0,0,0|2,0,0]=4 56 B27R3.3409116 COc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 273464a_100011912549_100000738651 [1,1,0,0,0,0|2,0,0]=4 57 B27R3.3409116 COc1ccc(cc1)C(O)CNC(=O)NCc2cccc3c2cc[nH]3 512a_100011912549_100000738651 [1,1,0,0,0,0|2,0,0]=4 58 B27R3.6281676 CN(CC(O)c1ccc(cc1)O)C(=O)NCc2cccc3c2cc[nH]3 2708a_100011912549_100016988945 [1,1,0,0,0,0|2,0,0]=4 59 B27R3.6281676 CN(CC(O)c1ccc(cc1)O)C(=O)NCc2cccc3c2cc[nH]3 273464a_100011912549_100016988945 [1,1,0,0,0,0|2,0,0]=4 60 B27R3.6429313 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(c(c3)O)O 273464a_100000106456_100011912549 [1,1,0,0,0,0|2,0,0]=4 61 B27R3.6429313 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(c(c3)O)O 273464a_100011912549_100000106456 [1,1,0,0,0,0|2,0,0]=4 62 B27R3.6429313 O=C(NCc1cccc2c1cc[nH]2)NCC(O)c3ccc(c(c3)O)O 512a_100011912549_100000106456 [1,1,0,0,0,0|2,0,0]=4 63 B27R3.59540770 Cn1ccc2c1cccc2CNC(=O)NCC(O)c3ccc(cc3)O 2708a_100011934857_100000067596 [1,1,0,0,0,0|2,0,0]=4 64 B27R3.59540770 Cn1ccc2c1cccc2CNC(=O)NCC(O)c3ccc(cc3)O 273464a_100011934857_100000067596 [1,1,0,0,0,0|2,0,0]=4 65 B27R3.59540770 Cn1ccc2c1cccc2CNC(=O)NCC(O)c3ccc(cc3)O 512a_100011934857_100000067596 [1,1,0,0,0,0|2,0,0]=4 66 B27R3.3353102 COc1ccc(cc1)C(O)CN(C)C(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100011290904 [0,1,0,0,1,0|2,0,0]=4 67 B27R3.59527590 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cccc3c2ccn3C 2430a_100000750317_100016988945 [0,1,0,0,1,0|2,0,0]=4 68 B27R3.368144740 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cc(cc3c2cc[nH]3)Br 2430a_106744500199_100016988945 [0,1,0,0,1,0|2,0,0]=4 69 B27R3.368144740 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cc(cc3c2cc[nH]3)Cl 2430a_100000086579_100016988945 [0,1,0,0,1,0|2,0,0]=4 70 B27R3.368144740 CN(CC(O)c1ccc(cc1)O)C(=O)Nc2cc(cc3c2cc[nH]3)F 2430a_100000085186_100016988945 [0,1,0,0,1,0|2,0,0]=4 71 B25R3.746874 CC(CNC(=O)Cc1cccc2c1cc[nH]2)c3ccc(cc3)O 527a_200015188644_100000094506 [1,0,0,0,1,0|2,0,0]=4 72 B25R3.746874 CC(CNC(=O)Nc1cccc2c1cc[nH]2)c3ccc(cc3)O 2430a_100011218720_200015188644 [1,0,0,0,1,0|1,0,0]=3 73 B25R3.746874 CC(CNC(=O)Nc1cccc2c1ccs2)c3ccc(cc3)O 2430a_100020628958_200015188644 [1,0,0,0,1,0|2,0,0]=4 74 B25R3.746874 Cc1ccc(cc1)C(O)CNC(=O)Cc2cccc3c2cc[nH]3 527a_200020610344_100000094506 [1,0,0,0,1,0|2,0,0]=4 75 B25R3.746874 Cc1ccc(cc1)C(O)CNC(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_200020610344 [1,0,0,0,1,0|1,0,0]=3 76 B25R3.746874 Cc1ccc(cc1)C(O)CNC(=O)Nc2cccc3c2ccs3 2430a_100020628958_200020610344 [1,0,0,0,1,0|2,0,0]=4 77 B25R3.746874 O=C(Cc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Br 527a_100020626992_100000094506 [1,0,0,0,1,0|2,0,0]=4 78 B25R3.746874 O=C(Cc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 11a_100000736658_100000094506 [1,0,0,0,1,0|2,0,0]=4 79 B25R3.746874 O=C(Cc1cccc2c1cc[nH]2)NCC(O)c3ccc(cc3)Cl 527a_100000736658_100000094506 [1,0,0,0,1,0|2,0,0]=4 80 B25R3.746874 O=C(Cc1cccc2c1cco2)NCC(O)c3ccc(cc3)O 240690a_100000067596_100000077588 [1,0,0,0,1,0|2,0,0]=4 81 B25R3.746874 O=C(NCC(O)c1ccc(cc1)Br)Nc2cccc3c2cc[nH]3 2430a_100011218720_100020626992 [1,0,0,0,1,0|1,0,0]=3 82 B25R3.746874 O=C(NCC(O)c1ccc(cc1)Br)Nc2cccc3c2ccs3 2430a_100020628958_100020626992 [1,0,0,0,1,0|2,0,0]=4 83 B25R3.746874 O=C(NCC(O)c1ccc(cc1)Cl)Nc2cccc3c2cc[nH]3 2430a_100011218720_100000736658 [1,0,0,0,1,0|1,0,0]=3 84 B25R3.746874 O=C(NCC(O)c1ccc(cc1)Cl)Nc2cccc3c2ccs3 2430a_100020628958_100000736658 [1,0,0,0,1,0|2,0,0]=4 85 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2[nH]cc3 2430a_100000685717_100000067596 [1,0,0,0,1,0|2,0,0]=4 86 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2[nH]cn3 2430a_100000740404_100000067596 [1,0,0,0,1,0|1,0,1]=4 87 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2[nH]cn3 512a_100000740404_100000067596 [1,0,0,0,1,0|1,0,1]=4 88 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100000067596 [1,0,0,0,1,0|0,0,0]=2 89 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2ccs3 2430a_100020628958_100000067596 [1,0,0,0,1,0|1,0,0]=3 90 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2nco3 512a_100000717946_100000067596 [1,0,0,0,1,0|2,0,0]=4 91 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2ncs3 2430a_100000046379_100000067596 [1,0,0,0,1,0|2,0,0]=4 92 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2ncs3 512a_100000046379_100000067596 [1,0,0,0,1,0|2,0,0]=4 93 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2scn3 2430a_100000099145_100000067596 [1,0,0,0,1,0|1,0,1]=4 94 B25R3.746874 O=C(NCC(O)c1ccc(cc1)O)Nc2cccc3c2scn3 512a_100000099145_100000067596 [1,0,0,0,1,0|1,0,1]=4 95 B25R3.746929 CN(CCc1ccc(cc1)O)C(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100016989440 [1,0,0,0,1,0|2,0,0]=4 96 B25R3.32666520 CN(CC(O)c1ccccc1)C(=O)Nc2cccc3c2cc[nH]3 2430a_100011218720_100000227976 [1,0,0,0,1,0|2,0,0]=4 97 B25R3.43016335 CN(CC(O)c1ccc(cc1)O)C(=O)c2cccc3c2cc[nH]3 240690a_100016988945_100000740066 [0,0,0,0,2,0|2,0,0]=4 98 B27R3.159735 O=C(C=Cc1cccc2c1cccc2)NCC(O)c3ccc(cc3)O 240690a_100000067596_100000735324 [1,0,0,0,0,1|2,0,0]=4 99 B27R3.159735 O=C(C=Cc1cccc2c1nccc2)NCC(O)c3ccc(cc3)O 240690a_100000067596_100000735392 [1,0,0,0,0,1|2,0,0]=4 100 B27R3.2888375 O=C(CC(=O)NCCc1ccc(cc1)Cl)Cc2cccc3c2cc[nH]3 1458a_100000094506_200000183373 [1,0,0,0,0,1|2,0,0]=4