0 B13R2.435 c1ccc2c(c1)CC(N2)C(=O)O HAA7840 [0,0,0,0,0,0|0,0,2]=2 1 B13R2.435 c1ccc2c(c1)C[C@H](N2)C(=O)O HAA1244 [0,0,0,0,0,0|0,0,2]=2 2 B13R2.435 c1ccc2c(c1)cc([nH]2)C(=O)O HAA8350 [0,0,0,0,0,0|0,0,0]=0 3 B14R2.4529 c1cc2c(cc1Br)cc([nH]2)C(=O)O HAA8170 [0,1,0,0,0,0|0,0,0]=1 4 B14R2.4529 c1cc2c(cc1O)cc([nH]2)C(=O)O HAA8230 [0,1,0,0,0,0|0,0,0]=1 5 B12R1.43 c1cc(cnc1)C[C@@H](C(=O)O)N HAA1230 [0,0,1,0,0,0|1,0,2]=4 6 B12R1.43 c1cc(cnc1)C[C@H](C(=O)O)N HAA1005 [0,0,1,0,0,0|1,0,2]=4 7 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N HAA7080 [0,0,1,0,0,0|1,0,2]=4 8 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N HAA1121 [0,0,1,0,0,0|0,0,2]=3 9 B12R1.43 c1ccc(cc1)C[C@H](C(=O)N)N HAA6430 [0,0,1,0,0,0|1,0,2]=4 10 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N HAA1045 [0,0,1,0,0,0|0,0,2]=3 11 B12R1.43 c1ccnc(c1)C[C@@H](C(=O)O)N HAA1229 [0,0,1,0,0,0|1,0,2]=4 12 B12R1.43 c1ccnc(c1)C[C@H](C(=O)O)N HAA5200 [0,0,1,0,0,0|1,0,2]=4 13 B12R1.43 c1cnccc1C[C@@H](C(=O)O)N HAA5540 [0,0,1,0,0,0|1,0,2]=4 14 B12R1.43 c1cnccc1C[C@@H](C(=O)O)N HAA6640 [0,0,1,0,0,0|1,0,2]=4 15 B14R2.781 c1ccc2c(c1)C[C@@H](NC2)C(=O)O HAA1054 [0,0,0,0,0,1|0,0,2]=3 16 B14R2.781 c1ccc2c(c1)C[C@H](NC2)C(=O)O HAA1133 [0,0,0,0,0,1|0,0,2]=3 17 B11R1.91 c1ccc(cc1)NCC(=O)O XAA1020 [1,0,1,0,0,0|0,0,1]=3 18 B13R1.133 Cc1ccc(cc1)C[C@@H](C(=O)O)N HAA7040 [0,1,1,0,0,0|0,0,2]=4 19 B13R1.133 Cc1ccc(cc1)C[C@H](C(=O)O)N HAA6410 [0,1,1,0,0,0|0,0,2]=4 20 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)Br HAA1117 [0,1,1,0,0,0|0,0,2]=4 21 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)Cl HAA1118 [0,1,1,0,0,0|0,0,2]=4 22 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)F HAA1119 [0,1,1,0,0,0|0,0,2]=4 23 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)I HAA1585 [0,1,1,0,0,0|0,0,2]=4 24 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)N HAA7050 [0,1,1,0,0,0|0,0,2]=4 25 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)N HAA7060 [0,1,1,0,0,0|0,0,2]=4 26 B13R1.133 c1cc(ccc1C[C@@H](C(=O)O)N)O HAA1142 [0,1,1,0,0,0|0,0,2]=4 27 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)Br HAA1234 [0,1,1,0,0,0|0,0,2]=4 28 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)Cl HAA1043 [0,1,1,0,0,0|0,0,2]=4 29 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)F HAA1510 [0,1,1,0,0,0|0,0,2]=4 30 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)I HAA6400 [0,1,1,0,0,0|0,0,2]=4 31 B13R1.133 c1cc(ccc1C[C@H](C(=O)O)N)O HAA1059 [0,1,1,0,0,0|0,0,2]=4 32 B13R1.135 COC(=O)[C@@H](Cc1ccccc1)N HAA5590 [0,1,1,0,0,0|0,0,2]=4 33 B13R1.135 COC(=O)[C@H](Cc1ccccc1)N HAA5660 [0,1,1,0,0,0|0,0,2]=4 34 B13R1.148 c1cc(cc(c1)Cl)C[C@@H](C(=O)O)N HAA7020 [0,1,1,0,0,0|0,0,2]=4 35 B13R1.148 c1cc(cc(c1)Cl)C[C@H](C(=O)O)N HAA6390 [0,1,1,0,0,0|0,0,2]=4 36 B13R1.148 c1cc(cc(c1)F)C[C@@H](C(=O)O)N HAA1528 [0,1,1,0,0,0|0,0,2]=4 37 B13R1.148 c1cc(cc(c1)F)C[C@H](C(=O)O)N HAA1567 [0,1,1,0,0,0|0,0,2]=4 38 B13R1.148 c1cc(cc(c1)O)C[C@H](C(=O)O)N HAA2040 [0,1,1,0,0,0|0,0,2]=4 39 B13R1.202 c1ccc(c(c1)C[C@@H](C(=O)O)N)Cl HAA1568 [0,1,1,0,0,0|0,0,2]=4 40 B13R1.202 c1ccc(c(c1)C[C@@H](C(=O)O)N)F HAA1569 [0,1,1,0,0,0|0,0,2]=4 41 B13R1.202 c1ccc(c(c1)C[C@H](C(=O)O)N)F HAA1566 [0,1,1,0,0,0|0,0,2]=4 42 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O HAA1216 [0,1,1,0,0,0|0,0,2]=4 43 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O HAA1199 [0,1,1,0,0,0|0,0,2]=4 44 B13R1.1073 C[C@@](Cc1ccccc1)(C(=O)O)N HAA1001 [0,1,1,0,0,0|0,0,2]=4 45 B13R1.1073 C[C@](Cc1ccccc1)(C(=O)O)N HAA1002 [0,1,1,0,0,0|0,0,2]=4 46 B15R2.7180 c1cc2c(cc1O)CN[C@@H](C2)C(=O)O HAA7230 [0,1,0,0,0,1|0,0,2]=4 47 B15R2.7180 c1cc2c(cc1O)CN[C@H](C2)C(=O)O HAA6560 [0,1,0,0,0,1|0,0,2]=4 48 B15R2.1592 COC(=O)c1c(c2ccccc2[nH]1)O XAA1060 [0,2,0,0,0,0|0,0,0]=2 49 B15R2.1356 CCOC(=O)c1cc2ccccc2[nH]1 XAA1210 [0,2,0,0,0,0|0,0,0]=2 50 B13R2.72 c1ccc2c(c1)c(c[nH]2)C(=O)O HAA8370 [0,0,1,1,0,0|2,0,0]=4 51 B11R1.36 c1ccc(cc1)[C@@H](C(=O)N)N HAA1516 [0,0,1,0,1,0|1,0,1]=4 52 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N HAA1122 [0,0,1,0,1,0|0,0,1]=3 53 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N HAA1046 [0,0,1,0,1,0|0,0,1]=3 54 B13R1.348 c1ccc(cc1)C[C@@H](CC(=O)O)N HAA8550 [0,0,1,0,0,1|0,0,2]=4 55 B13R1.348 c1ccc(cc1)C[C@H](CC(=O)O)N HAA8440 [0,0,1,0,0,1|0,0,2]=4 56 B13R1.351 c1ccc(cc1)CC[C@@H](C(=O)O)N HAA6720 [0,0,1,0,0,1|0,0,2]=4 57 B13R1.351 c1ccc(cc1)CC[C@H](C(=O)O)N HAA6250 [0,0,1,0,0,1|0,0,2]=4