0 B15R1.890 CC(=O)C(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000179758 [0,0,0,0,0,0|2,0,2]=4 1 B15R1.890 CC(C(=O)N)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000702099 [0,0,0,0,0,0|2,0,2]=4 2 B15R1.890 NC(=O)C(F)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100009813875 [0,0,0,0,0,0|2,0,2]=4 3 B15R1.890 O=C([O-])C(F)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100020610796 [0,0,0,0,0,0|1,0,3]=4 4 B14R1.685 CC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000070787_100000183813 [1,0,0,0,0,0|1,0,2]=4 5 B14R1.685 CC(=O)C[C@@H](O)c1ccc(c(c1)F)F 1458a_100000070787_100000761251 [1,0,0,0,0,0|3,0,0]=4 6 B14R1.685 NC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000187820 [1,0,0,0,0,0|1,0,2]=4 7 B14R1.685 O=C([O-])CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100020667443 [1,0,0,0,0,0|0,0,3]=4 8 B14R1.686 CC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100009814033_100009813601 [1,0,0,0,0,0|3,0,0]=4 9 B14R1.686 CC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200000210301 [1,0,0,0,0,0|2,0,0]=3 10 B14R1.686 CC(=O)N(C)Cc1ccc(c(c1)O)O 240690a_100020587154_100015343762 [1,0,0,0,0,0|3,0,0]=4 11 B14R1.686 CC(Nc1ccc(c(c1)O)O)C(=O)N 34a_100102946323_100000702099 [1,0,0,0,0,0|3,0,0]=4 12 B14R1.686 CC(Sc1ccc(c(c1)O)O)C(=O)N 62a_100000702099_100009813601 [1,0,0,0,0,0|3,0,0]=4 13 B14R1.686 NC(=O)C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100009813875 [1,0,0,0,0,0|3,0,0]=4 14 B14R1.686 NC(=O)C(F)Sc1ccc(c(c1)O)O 62a_100009813875_100009813601 [1,0,0,0,0,0|3,0,0]=4 15 B14R1.686 O=C([O-])C(F)Nc1ccc(c(c1)O)O 34a_100102946323_100020610796 [1,0,0,0,0,0|2,0,1]=4 16 B14R1.686 O=C([O-])C(F)Sc1ccc(c(c1)O)O 62a_100020610796_100009813601 [1,0,0,0,0,0|2,0,1]=4 17 B14R1.686 [13CH3]C(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_200025704644 [1,0,0,0,0,0|2,0,0]=3 18 B16R1.5433 COC(=O)C(C)C(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000211248 [0,1,0,0,0,0|1,0,2]=4 19 B16R1.1089 NC(=O)CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000187820 [0,0,0,0,0,1|2,0,1]=4 20 B16R1.1089 O=C([O-])CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100020667443 [0,0,0,0,0,1|1,0,2]=4 21 B13R1.132 CC(=O)CC(O)c1ccc(cc1)Cl 1458a_100000070787_200011996143 [2,0,0,0,0,0|2,0,0]=4 22 B13R1.132 CC(=O)C[C@H](O)c1ccc(cc1)F 1458a_100000070787_100000720402 [2,0,0,0,0,0|2,0,0]=4 23 B13R1.133 CC(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200000210301 [2,0,0,0,0,0|2,0,0]=4 24 B13R1.133 [13CH3]C(=O)C(O)Cc1ccc(cc1)O 1458a_100015278814_200025704644 [2,0,0,0,0,0|2,0,0]=4 25 B13R1.147 CC(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200000210301 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.147 [13CH3]C(=O)C[C@H](O)c1cccc(c1)Cl 1458a_100010423400_200025704644 [2,0,0,0,0,0|2,0,0]=4 27 B13R1.466 CNCC(O)c1ccc(c(c1)O)O 34a_100000106456_200000210301 [2,0,0,0,0,0|2,0,0]=4 28 B13R1.466 [13CH3]NCC(O)c1ccc(c(c1)O)O 34a_100000106456_200025704644 [2,0,0,0,0,0|2,0,0]=4 29 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200000210301 [2,0,0,0,0,0|1,0,0]=3 30 B13R1.511 CC(=O)CCc1ccc(c(c1)O)O 1458a_100000070787_200010393615 [2,0,0,0,0,0|1,0,0]=3 31 B13R1.511 CC(=O)NCc1ccc(c(c1)O)O 240690a_100000010075_100015343762 [2,0,0,0,0,0|2,0,0]=4 32 B13R1.511 NC(=O)CNc1ccc(c(c1)O)O 34a_100102946323_100000187820 [2,0,0,0,0,0|2,0,0]=4 33 B13R1.511 NC(=O)CSc1ccc(c(c1)O)O 62a_100000747473_100009813601 [2,0,0,0,0,0|2,0,0]=4 34 B13R1.511 O=C([O-])CNc1ccc(c(c1)O)O 34a_100102946323_100020667443 [2,0,0,0,0,0|1,0,1]=4 35 B13R1.511 O=C([O-])CSc1ccc(c(c1)O)O 62a_100020667443_100009813601 [2,0,0,0,0,0|1,0,1]=4 36 B13R1.511 [13CH3]C(=O)CCc1ccc(c(c1)O)O 1458a_100000042615_200025704644 [2,0,0,0,0,0|1,0,0]=3 37 B13R1.510 CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200000210301 [2,0,0,0,0,0|1,0,1]=4 38 B13R1.510 [13CH3]C(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_200025704644 [2,0,0,0,0,0|1,0,1]=4 39 B15R1.758 COC(=O)CC(=O)c1ccc(c(c1)O)O 1458a_100000212155_100000747449 [1,1,0,0,0,0|0,0,2]=4 40 B15R1.758 O=C(CO)CC(=O)c1ccc(c(c1)O)O 1458a_100000210174_100000183813 [1,1,0,0,0,0|0,0,2]=4 41 B15R1.758 O=C(CO)C[C@@H](O)c1ccc(c(c1)F)F 1458a_100000210174_100000761251 [1,1,0,0,0,0|2,0,0]=4 42 B15R1.676 CNC(Cc1ccc(c(c1)Cl)F)C(=O)O 269956a_103549770568_200000210301 [1,1,0,0,0,0|2,0,0]=4 43 B15R1.676 CN[C@@H](Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100011737835_200000210301 [1,1,0,0,0,0|2,0,0]=4 44 B15R1.676 CN[C@@H](Cc1ccc(c(c1)F)F)C(=O)O 269956a_100011737850_200000210301 [1,1,0,0,0,0|2,0,0]=4 45 B15R1.676 [13CH3]NC(Cc1ccc(c(c1)Cl)F)C(=O)O 269956a_103549770568_200025704644 [1,1,0,0,0,0|2,0,0]=4 46 B15R1.676 [13CH3]N[C@@H](Cc1ccc(c(c1)Cl)Cl)C(=O)O 269956a_100011737835_200025704644 [1,1,0,0,0,0|2,0,0]=4 47 B15R1.676 [13CH3]N[C@@H](Cc1ccc(c(c1)F)F)C(=O)O 269956a_100011737850_200025704644 [1,1,0,0,0,0|2,0,0]=4 48 B15R1.5521 CCC(=O)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100000210202 [1,1,0,0,0,0|2,0,0]=4 49 B15R1.5521 CN(Cc1ccc(c(c1)O)O)C(=O)CO 240690a_100020587154_100000210174 [1,1,0,0,0,0|2,0,0]=4 50 B15R1.5521 COC(=O)C(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000211248 [1,1,0,0,0,0|2,0,0]=4 51 B15R1.5521 COC(=O)C(C)Sc1ccc(c(c1)O)O 62a_100000211248_100009813601 [1,1,0,0,0,0|2,0,0]=4 52 B15R1.5521 O=C(CF)C(O)Cc1ccc(c(c1)O)O 1458a_100020667051_100015361967 [1,1,0,0,0,0|2,0,0]=4 53 B17R1.24228 COC(=O)CC(=O)C(O)c1ccc(c(c1)O)O 1458a_200000032065_100000747449 [0,1,0,0,0,1|1,0,1]=4 54 B15R1.889 CC(=O)NCC(O)c1ccc(c(c1)O)O 527a_100000106456_100103153847 [1,0,0,0,0,1|1,0,0]=3 55 B15R1.884 CC(NCc1ccc(c(c1)O)O)C(=O)N 34a_100000010075_100000702099 [1,0,0,0,0,1|2,0,0]=4 56 B15R1.884 NC(=O)C(F)NCc1ccc(c(c1)O)O 34a_100000010075_100009813875 [1,0,0,0,0,1|2,0,0]=4 57 B15R1.884 O=C([O-])C(F)NCc1ccc(c(c1)O)O 34a_100000010075_100020610796 [1,0,0,0,0,1|1,0,1]=4 58 B17R1.23503 CC(NCC(O)c1ccc(c(c1)O)O)C(=O)N 34a_100000106456_100000702099 [0,0,0,0,0,2|2,0,0]=4 59 B17R1.23503 NC(=O)C(F)NCC(O)c1ccc(c(c1)O)O 34a_100000106456_100009813875 [0,0,0,0,0,2|2,0,0]=4 60 B17R1.23503 O=C([O-])C(F)NCC(O)c1ccc(c(c1)O)O 34a_100000106456_100020610796 [0,0,0,0,0,2|1,0,1]=4