0 B14R2.8188 N[C@H]1CC2=C(C=CC=C2)N(O)C1=O E72225 [0,0,0,0,0,0|0,0,0]=0 1 B13R2.32 O[C@@H]1C2=C(C=CC=C2)CC[C@H]1Br V10227 [1,0,0,0,0,0|2,0,1]=4 2 B13R2.369 O=C1NC2=C(C=CC=C2)NC1=O W10297 [1,0,0,0,0,0|2,0,1]=4 3 B13R1.135 NNC(=O)[C@@H](N)CC1=CC=CC=C1 F10918 [0,0,1,0,0,0|1,0,0]=2 4 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 D88734 [1,0,1,0,0,0|2,0,0]=4 5 B12R1.43 CC(C)C(=O)NC1=CC=NC=C1 W16281 [1,0,1,0,0,0|2,0,0]=4 6 B12R1.43 C[C@@H](CC1=CC=CC=C1)C(=O)O A10414 [1,0,1,0,0,0|1,0,0]=3 7 B12R1.43 C[C@H](SC1=CC=CC=C1)C(=O)O W18223 [1,0,1,0,0,0|2,0,0]=4 8 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 F10693 [1,0,1,0,0,0|0,0,0]=2 9 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O N12125 [1,0,1,0,0,0|0,0,0]=2 10 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O A50242 [1,0,1,0,0,0|1,0,0]=3 11 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O N12178 [1,0,1,0,0,0|1,0,0]=3 12 B12R1.283 NCCC1=C([N+](=O)[O-])C=CC=C1 S10926 [1,0,1,0,0,0|0,0,2]=4 13 B14R1.3135 COC1=C(C[C@H](N)C(=O)O)C=CC=C1 N10810 [0,1,1,0,0,0|2,0,0]=4 14 B14R1.3135 COC1=C(C[C@H](N)C(=O)O)C=CC=C1 N12455 [0,1,1,0,0,0|2,0,0]=4 15 B14R1.3135 N#CC1=C(C[C@H](N)C(=O)O)C=CC=C1 A50206 [0,1,1,0,0,0|2,0,0]=4 16 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 AC6686 [0,1,1,0,0,0|2,0,0]=4 17 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Br)=C1 AC7063 [0,1,1,0,0,0|2,0,0]=4 18 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(F)=C1 64047 [0,1,1,0,0,0|2,0,0]=4 19 B14R1.1007 COC(=O)[C@@H](N)CC1=C(Cl)C=CC=C1 N10819 [0,1,1,0,0,0|2,0,0]=4 20 B14R1.1007 COC(=O)[C@@H](N)CC1=C(F)C=CC=C1 N12205 [0,1,1,0,0,0|2,0,0]=4 21 B14R2.4513 CN1C(=O)CCC2=C1C=C(Br)C=C2 E72662 [1,1,0,0,0,0|1,0,0]=3 22 B14R2.4513 CN1C(=O)CCC2=C1C=C(F)C=C2 C91010 [1,1,0,0,0,0|1,0,0]=3 23 B14R2.4513 CN1C(=O)COC2=C1C=C(Br)C=C2 71754 [1,1,0,0,0,0|2,0,0]=4 24 B14R2.29369 CN1C(=O)COC2=C1C=CC(Br)=C2 94702 [1,1,0,0,0,0|2,0,0]=4 25 B14R2.8239 C[C@@H]1SC2=C(C=C(Br)C=C2)NC1=O 77182 [1,1,0,0,0,0|2,0,0]=4 26 B14R2.972 COC(=O)[C@@H]1CC2=C(C=CC=C2)N1 I11546 [0,0,1,1,0,0|2,0,0]=4 27 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 D87899 [1,0,0,0,1,0|2,0,0]=4 28 B14R1.756 COC(=O)[C@@H](N)CCC1=CC=CC=C1 F52444 [0,0,1,0,0,1|2,0,0]=4