0 B14R1.685 CC1=C(Br)C=CC([C@@H](N)CC(=O)O)=C1 Y12888 [1,0,0,0,0,0|3,0,0]=4 1 B14R1.685 CC1=C(Br)C=CC([C@@H](N)CC(=O)O)=C1 Y12916 [1,0,0,0,0,0|3,0,0]=4 2 B14R1.685 N[C@@H](CC(=O)O)C1=CC(F)=C(O)C=C1 Y11123 [1,0,0,0,0,0|2,0,0]=3 3 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12213 [1,0,0,0,0,0|2,0,0]=3 4 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12503 [1,0,0,0,0,0|2,0,0]=3 5 B14R1.686 CC1=C(F)C=C(C[C@H](N)C(=O)O)C=C1 Y12504 [1,0,0,0,0,0|2,0,0]=3 6 B14R1.686 CC1=C(I)C=C(C[C@H](N)C(=O)O)C=C1 Y14808 [1,0,0,0,0,0|2,0,0]=3 7 B14R1.686 CC1=C(I)C=C(C[C@H](N)C(=O)O)C=C1 Y14809 [1,0,0,0,0,0|2,0,0]=3 8 B14R1.686 CC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 50865 [1,0,0,0,0,0|1,0,0]=2 9 B14R1.686 CC1=C(O)C=CC(C[C@H](N)C(=O)O)=C1 Y14826 [1,0,0,0,0,0|1,0,0]=2 10 B14R1.686 N[C@@H](CC1=CC(F)=C(Br)C=C1)C(=O)O Y12869 [1,0,0,0,0,0|2,0,0]=3 11 B14R1.686 N[C@@H](CC1=CC(F)=C(Br)C=C1)C(=O)O Y12902 [1,0,0,0,0,0|2,0,0]=3 12 B14R1.686 N[C@@H](CC1=CC(I)=C(Cl)C=C1)C(=O)O Y13414 [1,0,0,0,0,0|2,0,0]=3 13 B14R1.686 N[C@@H](CC1=CC(I)=C(F)C=C1)C(=O)O Y13412 [1,0,0,0,0,0|2,0,0]=3 14 B14R1.686 N[C@@H](CC1=CC(I)=C(F)C=C1)C(=O)O Y13413 [1,0,0,0,0,0|2,0,0]=3 15 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14209 [1,0,0,0,0,0|1,0,0]=2 16 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14230 [1,0,0,0,0,0|1,0,0]=2 17 B14R1.686 N[C@@H](CC1=CC(O)=C(F)C=C1)C(=O)O Y14248 [1,0,0,0,0,0|1,0,0]=2 18 B14R1.686 O=C(O)[C@@H](O)CC1=CC(O)=C(O)C=C1 A12835 [1,0,0,0,0,0|1,0,0]=2 19 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(O)C=C1 Y13617 [2,0,0,0,0,0|1,0,0]=3 20 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CN=C1 Y12875 [2,0,0,0,0,0|2,0,0]=4 21 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CN=C1 Y12906 [2,0,0,0,0,0|2,0,0]=4 22 B13R1.148 N[C@@H](CC1=CC(Cl)=CN=C1)C(=O)O Y12876 [2,0,0,0,0,0|2,0,0]=4 23 B13R1.148 N[C@@H](CC1=CC(Cl)=CN=C1)C(=O)O Y12907 [2,0,0,0,0,0|2,0,0]=4 24 B13R1.148 N[C@@H](CC1=CC(F)=CN=C1)C(=O)O Y10843 [2,0,0,0,0,0|2,0,0]=4 25 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O Y11468 [2,0,0,0,0,0|0,0,0]=2 26 B15R1.3776 COC1=C(Br)C=C([C@@H](N)CC(=O)O)C=C1 Y13620 [1,1,0,0,0,0|2,0,0]=4 27 B15R1.3776 COC1=C(F)C=C([C@@H](N)CC(=O)O)C=C1 Y13643 [1,1,0,0,0,0|2,0,0]=4 28 B15R1.3777 COC1=C(O)C=C(C[C@H](N)C(=O)O)C=C1 Y13614 [1,1,0,0,0,0|0,0,0]=2 29 B15R1.3777 COC1=C(O)C=C(C[C@H](N)C(=O)O)C=C1 Y14115 [1,1,0,0,0,0|0,0,0]=2 30 B15R1.4038 COC1=C(O)C=CC(C[C@H](O)C(=O)O)=C1 W12319 [1,1,0,0,0,0|1,0,0]=3 31 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(C)=C(Br)C=C1 Y12087 [1,1,0,0,0,0|2,0,0]=4 32 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(F)=C(C)C=C1 Y11939 [1,1,0,0,0,0|2,0,0]=4 33 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(F)=C(C)C=C1 Y11940 [1,1,0,0,0,0|2,0,0]=4 34 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(F)=C(C)C=C1 Y13033 [1,1,0,0,0,0|2,0,0]=4 35 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(F)=C(F)C=C1 Y13742 [1,1,0,0,0,0|2,0,0]=4 36 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(F)=C(O)C=C1 Y14864 [1,1,0,0,0,0|1,0,0]=3 37 B15R1.8394 N[C@@H](CC1=C(O)C=C(O)C(O)=C1)C(=O)O P19978 [1,1,0,0,0,0|0,0,0]=2