0 B15R1.48 CCOC(=O)C(N)CC1=CC=C(O)C=C1 T19185 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(O)C=C1 T6308 [0,0,0,0,0,0|0,0,0]=0 2 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(O)C=C1 M8849 [1,0,0,0,0,0|2,0,0]=3 3 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 T8807 [1,0,0,0,0,0|0,0,0]=1 4 B14R1.502 CCOC(=O)\C=C\C1=CC=C(F)C=C1 F8771 [1,0,0,0,0,0|1,0,2]=4 5 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 E8648 [1,0,0,0,0,0|1,0,2]=4 6 B14R1.502 CCOC(=O)\N=C\C1=CC=C(Cl)C=C1 C9524 [1,0,0,0,0,0|2,0,1]=4 7 B14R1.502 CCOC(=O)\N=C\C1=CC=C(F)C=C1 F8804 [1,0,0,0,0,0|2,0,1]=4 8 B16R2.755 CCOC(=O)C1=CC2=C(C=C(Cl)C=C2)N1 C10052 [0,0,0,1,0,0|1,0,2]=4 9 B16R2.755 CCOC(=O)C1=CC2=C(C=C(F)C=C2)N1 E9326 [0,0,0,1,0,0|1,0,2]=4 10 B16R2.755 CCOC(=O)C1=CC2=CC=C(Br)C=C2N1 E12022 [0,0,0,1,0,0|1,0,2]=4 11 B16R2.755 CCOC(=O)C1=CC2=CC=C(C)C=C2N1 E12020 [0,0,0,1,0,0|1,0,2]=4 12 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 E9575 [0,0,0,0,1,0|2,0,1]=4 13 B16R1.955 CCOC(=O)CC(=O)CC1=CC=C(C)C=C1 O15882 [0,0,0,0,0,1|2,0,1]=4 14 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 E8209 [2,0,0,0,0,0|1,0,1]=4 15 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 P11245 [2,0,0,0,0,0|1,0,0]=3 16 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 E8131 [2,0,0,0,0,0|0,0,0]=2 17 B13R1.135 CNC(=O)C(C)CC1=CC=CC=C1 M13164 [2,0,0,0,0,0|2,0,0]=4 18 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 P0936 [2,0,0,0,0,0|0,0,0]=2 19 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 P0936 [2,0,0,0,0,0|0,0,0]=2 20 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 M8214 [2,0,0,0,0,0|1,0,0]=3 21 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 M1255 [2,0,0,0,0,0|0,0,0]=2 22 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 M8123 [2,0,0,0,0,0|0,0,2]=4 23 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 M8123 [2,0,0,0,0,0|0,0,2]=4 24 B13R1.133 C[C@@H](OC1=CC=C(O)C=C1)C(=O)O H8280 [2,0,0,0,0,0|2,0,0]=4 25 B13R1.133 NC(=O)[C@@H](N)CC1=CC=C(O)C=C1 T2383 [2,0,0,0,0,0|1,0,0]=3 26 B13R1.133 NC(CC1=CC=C(F)C=C1)C(=O)O F2315 [2,0,0,0,0,0|1,0,0]=3 27 B13R1.133 NC(CC1=CC=C(I)C=C1)C(=O)O I0355 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 A5097 [2,0,0,0,0,0|1,0,0]=3 29 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O B10803 [2,0,0,0,0,0|1,0,0]=3 30 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O C0354 [2,0,0,0,0,0|1,0,0]=3 31 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O F6348 [2,0,0,0,0,0|1,0,0]=3 32 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O I6328 [2,0,0,0,0,0|1,0,0]=3 33 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O T19184 [2,0,0,0,0,0|0,0,0]=2 34 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O B10804 [2,0,0,0,0,0|1,0,0]=3 35 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O C9004 [2,0,0,0,0,0|1,0,0]=3 36 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O F8323 [2,0,0,0,0,0|1,0,0]=3 37 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O T6097 [2,0,0,0,0,0|0,0,0]=2 38 B15R1.578 CCOC(=O)C(N)C(O)C1=CC=CC=C1 A14500 [1,1,0,0,0,0|0,0,0]=2 39 B15R1.578 CCOC(=O)C(N)C(O)C1=CC=CC=C1 A14500 [1,1,0,0,0,0|0,0,0]=2 40 B15R1.11652 COC(=O)C(C)(N)CC1=CC=C(O)C=C1 M16894 [1,1,0,0,0,0|0,0,0]=2 41 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 O9278 [1,1,0,0,0,0|1,0,1]=4 42 B15R1.23 CCOC(=O)CC(N)C1=CC=C(Cl)C=C1 A14472 [1,1,0,0,0,0|1,0,0]=3 43 B15R1.23 CCOC(=O)CC(N)C1=CC=C(O)C=C1 A14475 [1,1,0,0,0,0|0,0,0]=2 44 B15R1.23 CCOC(=O)C[C@H](N)C1=CC=C(F)C=C1 A15296 [1,1,0,0,0,0|1,0,0]=3 45 B15R1.3943 CCOC(=O)C(=O)C1=CC=C(OC)C=C1 E9373 [0,1,0,0,1,0|1,0,1]=4 46 B17R1.1019 CCOC(=O)C(CNC)CC1=CC=C(Cl)C=C1 E18565 [0,2,0,0,0,0|1,0,0]=3 47 B17R1.21042 CCOC(=O)C(CC1=CC=C(F)C=C1)C(C)=O F10591 [0,2,0,0,0,0|2,0,0]=4 48 B17R1.8287 CC(C)(C)OC(=O)[C@@H](N)CC1=CC=C(O)C=C1 T2900 [0,2,0,0,0,0|0,0,0]=2 49 B17R1.5682 CCOC(=O)[C@@H](N)CC1=CC=C([N+](=O)[O-])C=C1 N18182 [0,2,0,0,0,0|0,0,1]=3 50 B17R1.127650 CCOC(=O)[C@@](C)(N)CC1=CC(O)=C(O)C=C1 M6275 [0,2,0,0,0,0|0,0,0]=2 51 B15R2.38 O=C1CCCCC1CC2=CC=CC=C2 B8534 [1,0,0,1,0,0|2,0,0]=4 52 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 B8643 [1,0,0,1,0,0|1,0,1]=4 53 B15R2.325 O=C1N[C@H](CC2=CC=CC=C2)C(=O)O1 B8644 [1,0,0,1,0,0|1,0,1]=4 54 B15R2.1356 CCOC(=O)C1=CC2=CC=CC=C2N1 I1761 [1,0,0,1,0,0|0,0,2]=4 55 B15R2.1356 CCOC(=O)[C@@H]1CC2=C(C=CC=C2)N1 I17976 [1,0,0,1,0,0|0,0,0]=2 56 B17R2.49948 CCOC(=O)C1=CC2=CC=C(OC)C=C2N1 E12017 [0,1,0,1,0,0|0,0,2]=4 57 B13R1.47 CCOC(=O)C(=O)C1=CC=CC=C1 E8121 [1,0,0,0,1,0|1,0,1]=4 58 B13R1.47 CCOC(=O)C(N)C1=CC=CC=C1 E9709 [1,0,0,0,1,0|0,0,0]=2 59 B13R1.21 COC(=O)C(N)C1=CC=C(O)C=C1 M8252 [1,0,0,0,1,0|0,0,0]=2 60 B15R1.809 CCOC(=O)\C=C(\N)OC1=CC=CC=C1 A15239 [1,0,0,0,0,1|1,0,1]=4 61 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 E9275 [1,0,0,0,0,1|1,0,1]=4 62 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 H7010 [1,0,0,0,0,1|0,0,0]=2 63 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 H7010 [1,0,0,0,0,1|0,0,0]=2 64 B15R1.826 CCOC(=O)[C@@H](O)CCC1=CC=CC=C1 E7192 [1,0,0,0,0,1|1,0,0]=3 65 B15R1.826 CCOC(=O)[C@H](O)CCC1=CC=CC=C1 E4092 [1,0,0,0,0,1|1,0,0]=3