0 B14R1.3 C=C(C)C(=O)NC1=CC=C(OC)C=C1 CS-0037033 [0,0,0,0,0,0|3,0,0]=3 1 B14R1.3 CSC1=CC=C(C[C@H](N)C(=O)O)C=C1 CS-0089335 [0,0,0,0,0,0|1,1,1]=3 2 B13R1.3 COC1=CC=C(\C=C\B(O)O)C=C1 CS-0110014 [1,0,0,0,0,0|1,0,2]=4 3 B13R1.3 N#CC1=CC=C(\C=C\C(=O)O)C=C1 CS-0100042 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.133 N[C@@H](CC1=CC=C(O)C=N1)C(=O)O CS-0100354 [1,0,0,0,0,0|2,0,1]=4 5 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 CS-0062179 [1,0,0,0,0,0|2,0,0]=3 6 B13R1.133 O=C(O)C(=O)NC1=NC=C(Cl)C=C1 CS-0053035 [1,0,0,0,0,0|3,0,0]=4 7 B15R1.216 COC1=CC=C(C[C@](C)(N)C(=O)O)C=C1 CS-0088876 [0,1,0,0,0,0|1,0,1]=3 8 B15R1.495 O=C(O)C(=O)CC1=CC=C([N+](=O)[O-])C=C1 CS-0045326 [0,1,0,0,0,0|2,0,0]=3 9 B15R2.4834 COC1=CC2=C(C=C1)N=C(C(=O)O)S2 CS-0067221 [0,0,0,1,0,0|1,1,0]=3 10 B15R2.4834 COC1=CC=C2C=C(C(=O)O)OC2=C1 CS-0062580 [0,0,0,1,0,0|0,0,2]=3 11 B15R2.4834 COC1=CC=C2C=C(C(C)=O)OC2=C1 CS-0062571 [0,0,0,1,0,0|1,0,2]=4 12 B15R2.4834 COC1=CC=C2OC(C(=O)O)=CC2=C1 CS-0061982 [0,0,0,1,0,0|2,0,0]=3 13 B15R2.4834 COC1=CC=C2OC(C(C)=O)=CC2=C1 CS-0029601 [0,0,0,1,0,0|3,0,0]=4 14 B15R2.4834 COC1=CN2C=C(C(=O)O)N=C2C=C1 CS-0050178 [0,0,0,1,0,0|3,0,0]=4 15 B15R2.21336 COC1=CC=C2N=C(C)C(=O)NC2=C1 CS-0087948 [0,0,0,1,0,0|3,0,0]=4 16 B12R1.21 CC1=CC=C(CCC(=O)O)C=N1 CS-0037502 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.21 CC1=CC=C(CCC(=O)O)N=C1 CS-0038739 [2,0,0,0,0,0|1,0,1]=4 18 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 CS-0072209 [2,0,0,0,0,0|1,0,1]=4 19 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 CS-0088991 [2,0,0,0,0,0|1,0,1]=4 20 B12R1.4 CCC1=CC=C(CC(C)=O)C=C1 CS-0036325 [2,0,0,0,0,0|1,0,1]=4 21 B12R1.4 COC1=CC=C(CC(=O)O)C=N1 CS-0082326 [2,0,0,0,0,0|1,0,0]=3 22 B12R1.4 COC1=CN=C(CC(=O)O)C=C1 CS-0062008 [2,0,0,0,0,0|1,0,0]=3 23 B12R1.4 N#CC1=CC=C(CC(=O)O)C=C1 CS-0047595 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 CS-0061780 [2,0,0,0,0,0|2,0,0]=4 25 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 CS-0099715 [2,0,0,0,0,0|2,0,0]=4 26 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O CS-0106156 [2,0,0,0,0,0|1,0,1]=4 27 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 CS-0060520 [2,0,0,0,0,0|1,0,1]=4 28 B14R1.2 COC1=CC=C(C(N)CC(=O)O)C=C1 CS-0113048 [1,1,0,0,0,0|0,0,1]=3 29 B14R1.2 COC1=CC=C([C@@H](N)CC(=O)O)C=C1 CS-0113022 [1,1,0,0,0,0|0,0,1]=3 30 B14R1.2 COC1=CC=C([C@H](N)CC(=O)O)C=C1 CS-0113099 [1,1,0,0,0,0|0,0,1]=3 31 B14R1.103 COC1=CC(F)=C(C=CC(=O)O)C=C1 CS-0038428 [1,1,0,0,0,0|0,0,1]=3 32 B14R1.103 COC1=CC=C(\C=C\C(=O)O)C(F)=C1 CS-0100037 [1,1,0,0,0,0|0,0,1]=3 33 B14R1.419 CN(C)C1=CC=C(CCC(=O)O)C=C1 CS-0061712 [1,1,0,0,0,0|1,0,1]=4 34 B14R1.3652 COC1=C(O)C=C(C(O)C(=O)O)C=C1 CS-0072520 [0,1,0,0,1,0|0,0,2]=4 35 B16R1.69 CCCOC1=CC=C(C[C@H](N)C(=O)O)C=C1 CS-0090048 [0,2,0,0,0,0|1,0,1]=4 36 B16R1.69 CCCOC1=CC=C(C[C@H](N)C(=O)O)C=C1 CS-0090050 [0,2,0,0,0,0|1,0,1]=4 37 B14R2.134 COC1=CC=C2COC(=O)CC2=C1 CS-0036929 [1,0,0,1,0,0|2,0,0]=4 38 B14R2.2332 COC1=CC=C2NC(=O)COC2=C1 CS-0087992 [1,0,0,1,0,0|1,0,1]=4 39 B14R2.3304 COC1=CC2=C(C=C1)N=C(C=O)S2 CS-0067205 [1,0,0,1,0,0|1,1,0]=4 40 B14R2.3304 COC1=CC=C2SC(C=O)=CC2=C1 CS-0061983 [1,0,0,1,0,0|2,0,0]=4 41 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(O)C=C2 CS-0053572 [1,0,0,1,0,0|1,0,1]=4 42 B14R2.4529 CC1=CC=C2C=C(C(=O)O)OC2=C1 CS-0062592 [1,0,0,1,0,0|0,0,2]=4 43 B14R2.4529 CC1=CC=C2OC(C(=O)O)=CC2=C1 CS-0062601 [1,0,0,1,0,0|2,0,0]=4 44 B14R2.4529 O=C(O)C1=CC2=CC(O)=CC=C2O1 CS-0043690 [1,0,0,1,0,0|2,0,0]=4 45 B14R2.4529 O=C(O)C1=CC2=CC=C(O)C=C2O1 CS-0062590 [1,0,0,1,0,0|0,0,2]=4 46 B16R2.7526 COC1=CC=C2OC(C(=O)O)=C(C)C2=C1 CS-0062564 [0,1,0,1,0,0|2,0,0]=4 47 B16R2.1933 COC1=C(Br)C=C2C=C(C(=O)O)OC2=C1 CS-0061924 [0,1,0,1,0,0|0,0,2]=4 48 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 CS-0061778 [1,0,0,0,1,0|2,0,0]=4 49 B12R1.5 COC1=CC=C(C(=O)C#N)C=C1 CS-0107123 [1,0,0,0,1,0|1,0,1]=4 50 B12R1.20 CC1=CC=C(C(F)C(=O)O)C=C1 CS-0104543 [1,0,0,0,1,0|1,0,1]=4 51 B14R1.698 O=C(O)CC(=O)NC1=CC=C(F)C=C1 CS-0060252 [1,0,0,0,0,1|2,0,0]=4