0 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 FBZ [0,0,0,0,0,0|2,0,0]=2 1 B12R1.107 C\C(=C/N(=O)=O)\c1ccccc1 1L5 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.107 c1ccc(cc1)C(CC(=O)O)N SFE [0,0,0,0,0,0|3,0,0]=3 3 B11R1.91 CC(=O)OCc1ccccc1 J0Z [1,0,0,0,0,0|0,0,0]=1 4 B11R1.91 C[C@H](CCc1ccccc1)N 4DD [1,0,0,0,0,0|2,0,1]=4 5 B11R1.91 c1ccc(cc1)/C=C/C(=O)O TCA [1,0,0,0,0,0|2,0,1]=4 6 B11R1.91 c1ccc(cc1)CCC(=O)O HCI [1,0,0,0,0,0|2,0,0]=3 7 B11R1.91 c1ccc(cc1)CNC(=O)O PMQ [1,0,0,0,0,0|2,0,0]=3 8 B11R1.91 c1ccc(cc1)COC(=O)Cl PHQ [1,0,0,0,0,0|1,0,0]=2 9 B11R1.91 c1ccc(cc1)COC(=O)O BGG [1,0,0,0,0,0|1,0,0]=2 10 B11R1.91 c1ccc(cc1)OCC(=O)N PO6 [1,0,0,0,0,0|3,0,0]=4 11 B11R1.91 c1ccc(cc1)OCC(=O)O 06Y [1,0,0,0,0,0|3,0,0]=4 12 B11R1.91 c1ccc(cc1)\C=C\C(=O)N DH6 [1,0,0,0,0,0|2,0,1]=4 13 B13R1.132 C\C(=C/C(=O)O)\c1ccc(cc1)Cl 6ZX [0,1,0,0,0,0|2,0,1]=4 14 B13R1.152 C[C@@H](c1ccccc1)[C@@H](C(=O)O)N 41H [0,1,0,0,0,0|2,0,0]=3 15 B13R1.152 C[C@H](c1ccccc1)C(=O)C(=O)O 56D [0,1,0,0,0,0|2,0,0]=3 16 B13R1.152 c1ccc(cc1)[C@@H]([C@@H](C(=O)O)N)O BB8 [0,1,0,0,0,0|3,0,0]=4 17 B13R1.152 c1ccc(cc1)[C@H]([C@@H](C(=O)O)N)O H14 [0,1,0,0,0,0|3,0,0]=4 18 B13R1.152 c1ccc(cc1)[C@H]([C@@H](C(=O)O)O)O M74 [0,1,0,0,0,0|3,0,0]=4 19 B13R2.328 CC1=CC(=O)Oc2c1cccc2 ZZ1 [0,0,0,1,0,0|2,0,1]=4 20 B11R1.36 C[C@H]([C@@H](c1ccccc1)O)N NPU [0,0,0,0,1,0|2,0,1]=4 21 B11R1.36 C[C@H](c1ccccc1)C(=O)O GRO [0,0,0,0,1,0|1,0,0]=2 22 B11R1.36 c1ccc(cc1)C(=O)C(=O)O 173 [0,0,0,0,1,0|2,0,1]=4 23 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)N 004 [0,0,0,0,1,0|2,0,0]=3 24 B11R1.36 c1ccc(cc1)[C@@H](C(=O)O)O SMN [0,0,0,0,1,0|2,0,0]=3 25 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N PG9 [0,0,0,0,1,0|2,0,0]=3 26 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)N PGY [0,0,0,0,1,0|2,0,0]=3 27 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)O RMN [0,0,0,0,1,0|2,0,0]=3 28 B11R1.36 c1ccc(cc1)[C@H](C(=O)O)S RTD [0,0,0,0,1,0|2,0,0]=3 29 B13R1.348 c1ccc(cc1)C[C@@H](CC(=O)O)N 3FB [0,0,0,0,0,1|3,0,0]=4 30 B13R1.348 c1ccc(cc1)C[C@H](N)NC(=O)O APE [0,0,0,0,0,1|3,0,0]=4 31 B10R1.15 CC[C@@H](C)c1ccccc1 3GY [2,0,0,0,0,0|0,0,1]=3 32 B10R1.15 C[C@H](C=O)c1ccccc1 1LP [2,0,0,0,0,0|0,0,0]=2 33 B10R1.17 CCCCc1ccccc1 N4B [2,0,0,0,0,0|1,0,1]=4 34 B10R1.17 c1ccc(cc1)CCC=O 3PL [2,0,0,0,0,0|1,0,0]=3 35 B10R1.17 c1ccc(cc1)CNC=O BNF [2,0,0,0,0,0|1,0,0]=3 36 B10R1.17 c1ccc(cc1)CNC=S 9BE [2,0,0,0,0,0|1,1,0]=4 37 B10R1.17 c1ccc(cc1)COC=O BZO [2,0,0,0,0,0|0,0,0]=2 38 B10R1.17 c1ccc(cc1)COC=O CBZ [2,0,0,0,0,0|0,0,0]=2 39 B12R1.3 CC[C@H](c1ccccc1)NC=O BAS [1,1,0,0,0,0|1,0,0]=3 40 B12R1.34 C[C@@H](c1ccccc1)N(C)C=O PHC [1,1,0,0,0,0|1,0,0]=3 41 B12R1.21 Cc1ccc(cc1)CCC(=O)O PPT [1,1,0,0,0,0|2,0,0]=4 42 B12R1.21 c1cc(ccc1CCC(=O)N)Br TCF [1,1,0,0,0,0|2,0,0]=4 43 B12R1.21 c1cc(ccc1CCC(=O)N)O SGI [1,1,0,0,0,0|2,0,0]=4 44 B12R1.21 c1cc(ccc1CCC(=O)O)Cl S0W [1,1,0,0,0,0|2,0,0]=4 45 B12R1.21 c1cc(ccc1CCC(=O)O)N AHC [1,1,0,0,0,0|2,0,0]=4 46 B12R1.21 c1cc(ccc1CCC(=O)O)O HPP [1,1,0,0,0,0|2,0,0]=4 47 B12R1.43 CC(=O)[C@H](Cc1ccccc1)N HPC [1,1,0,0,0,0|1,0,0]=3 48 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O DPH [1,1,0,0,0,0|2,0,0]=4 49 B12R1.43 c1ccc(cc1)CC(=O)C(=O)O 1PY [1,1,0,0,0,0|2,0,0]=4 50 B12R1.43 c1ccc(cc1)CC(=O)C(=O)O PPY [1,1,0,0,0,0|2,0,0]=4 51 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)N)N NFA [1,1,0,0,0,0|2,0,0]=4 52 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)Cl WJ1 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N PHE [1,1,0,0,0,0|2,0,0]=4 54 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)N PHE_LFOH [1,1,0,0,0,0|2,0,0]=4 55 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)O HFA [1,1,0,0,0,0|2,0,0]=4 56 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)O LLA [1,1,0,0,0,0|2,0,0]=4 57 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)O LOF [1,1,0,0,0,0|2,0,0]=4 58 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)O)[NH-] PHE_LEO2H [1,1,0,0,0,0|2,0,0]=4 59 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)[O-])[NH-] PHE_LEO2 [1,1,0,0,0,0|2,0,0]=4 60 B12R1.43 c1ccc(cc1)C[C@@H](C(=O)[O-])[NH3+] PHE_LFZW [1,1,0,0,0,0|2,0,0]=4 61 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)Cl WJ2 [1,1,0,0,0,0|2,0,0]=4 62 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)N DPN [1,1,0,0,0,0|2,0,0]=4 63 B12R1.43 c1ccc(cc1)C[C@H](C(=O)O)O HF2 [1,1,0,0,0,0|2,0,0]=4 64 B12R1.125 Cc1ccccc1CCC(=O)O 02Q [1,1,0,0,0,0|2,0,0]=4 65 B12R1.20 c1cc(ccc1[C@@H](C(=O)O)N)O D4P [0,1,0,0,1,0|2,0,0]=4 66 B12R1.20 c1cc(ccc1[C@@H](C(=O)O)O)O HHH [0,1,0,0,1,0|2,0,0]=4 67 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)O DGH [0,1,0,0,1,0|2,0,0]=4 68 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)O GHP [0,1,0,0,1,0|2,0,0]=4 69 B12R1.20 c1cc(ccc1[C@H](C(=O)O)N)O NTY [0,1,0,0,1,0|2,0,0]=4 70 B12R1.225 C[C@@H](c1cccc(c1)O)N(C)C SAF [0,1,0,0,1,0|2,0,0]=4 71 B12R1.225 c1cc(cc(c1)Cl)[C@H](C(=O)O)O 47E [0,1,0,0,1,0|2,0,0]=4 72 B12R1.253 C[C@@](c1ccccc1)(C(=O)O)N GRN [0,1,0,0,1,0|1,0,0]=3 73 B12R1.253 C[C@](c1ccccc1)(C(=O)O)O APG [0,1,0,0,1,0|1,0,0]=3 74 B12R1.253 C[C@](c1ccccc1)(C(=O)O)O SAA [0,1,0,0,1,0|1,0,0]=3 75 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O MPQ [0,1,0,0,1,0|1,0,0]=3 76 B14R1.160 CC(=O)ONC(=O)c1ccccc1O SCL [0,1,0,0,0,1|1,0,1]=4 77 B14R1.1019 c1cc(ccc1[C@@H](CC(=O)O)CN)Cl 2C0 [0,2,0,0,0,0|2,0,0]=4 78 B14R1.1027 CO[C@H](c1ccccc1)[C@@H](C(=O)O)N WPA [0,2,0,0,0,0|2,0,0]=4 79 B14R1.1027 CO[C@H](c1ccccc1)[C@H](C(=O)O)O M72 [0,2,0,0,0,0|2,0,0]=4 80 B12R2.2 c1ccc(cc1)[C@H]2CCCN2 96B [1,0,0,1,0,0|1,0,1]=4 81 B12R2.1081 C[C@@H]1c2ccccc2CCN1 YLG [1,0,0,1,0,0|1,0,1]=4 82 B14R2.738 C[C@@H]1CC(=O)Nc2ccccc2N1 98 [0,0,0,1,0,1|2,0,0]=4 83 B14R2.7724 CC1=CC(=O)N(c2c1cccc2)C ZXZ [0,1,0,1,0,0|1,0,1]=4 84 B10R1.18 CC(=O)Oc1ccccc1 QY9 [1,0,0,0,1,0|0,0,0]=2 85 B10R1.18 CC(C)Cc1ccccc1 I4B [1,0,0,0,1,0|1,0,1]=4 86 B10R1.18 C[C@@H](Cc1ccccc1)N 1WE [1,0,0,0,1,0|1,0,1]=4 87 B10R1.18 C[C@H](Cc1ccccc1)N FRD [1,0,0,0,1,0|1,0,1]=4 88 B10R1.18 c1ccc(cc1)CC(=O)O PAC [1,0,0,0,1,0|1,0,0]=3 89 B10R1.18 c1ccc(cc1)NC(=O)N PHU [1,0,0,0,1,0|2,0,0]=4 90 B12R1.252 CC(=O)NCCc1ccccc1 54W [1,0,0,0,0,1|1,0,0]=3 91 B12R1.252 c1ccc(cc1)CCCC(=O)O CLT [1,0,0,0,0,1|2,0,0]=4 92 B12R1.252 c1ccc(cc1)CNCC(=O)O 04Q [1,0,0,0,0,1|2,0,0]=4