0 B12R1.4 CCC1=CC=C(OC(C)=O)C=C1 CS-0152509 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 CS-W018180 [1,0,0,0,0,0|1,0,1]=3 2 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 CS-0063380 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.20 CC(=O)NC1=NC=C(Br)C=C1 CS-0042104 [1,0,0,0,0,0|3,0,0]=4 4 B11R1.20 CC(=O)SC1=CC=C(I)C=C1 CS-1050905 [1,0,0,0,0,0|2,0,0]=3 5 B11R1.20 O=C(O)CC1=CC=C(F)N=C1 CS-0643411 [1,0,0,0,0,0|3,0,0]=4 6 B13R1.4 COC1=CC=C(CC(C)(C)N)C=C1 CS-0047674 [0,1,0,0,0,0|1,0,1]=3 7 B13R1.35 COC1=CC=C(CC(=O)O)C=C1C CS-W001167 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.35 COC1=CC=C(CC(N)=O)C=C1F CS-0257753 [0,1,0,0,0,0|1,0,0]=2 9 B13R1.36 CC(C(=O)O)C1=CC=C(C=O)C=C1 CS-0131913 [0,1,0,0,0,0|3,0,0]=4 10 B13R1.36 COC1=CC=C(C(O)C(=O)O)C=C1 CS-W017120 [0,1,0,0,0,0|1,0,0]=2 11 B13R1.585 CC(=O)NC1=CC=C(S(=O)[O-])C=C1 CS-W014738 [0,1,0,0,0,0|2,1,0]=4 12 B13R1.585 CC(C)CC1=CC=C(C(C)N)C=C1 CS-0884913 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.653 N#CC1=CC=C(CC(=O)O)C(F)=C1 CS-0311093 [0,1,0,0,0,0|3,0,0]=4 14 B13R2.2121 COC1=CC2=C(C=C1)N=C(Cl)O2 CS-0643151 [0,0,0,1,0,0|2,0,1]=4 15 B13R2.2121 COC1=CC=C2OC(Cl)=NC2=C1 CS-0102225 [0,0,0,1,0,0|3,0,0]=4 16 B13R2.2121 COC1=CC=C2OC(N)=NC2=C1 CS-0210491 [0,0,0,1,0,0|3,0,0]=4 17 B13R2.2121 COC1=CC=C2SC(Br)=NC2=C1 CS-0063184 [0,0,0,1,0,0|3,0,0]=4 18 B11R1.3 C#CC1=CN=C(C(C)=O)C=C1 CS-0609792 [0,0,0,0,1,0|2,0,1]=4 19 B11R1.3 CCC1=CC=C(C(C)N)C=C1 CS-0446774 [0,0,0,0,1,0|2,0,1]=4 20 B11R1.3 CCC1=CC=C(C(C)O)C=C1 CS-0451316 [0,0,0,0,1,0|1,0,2]=4 21 B11R1.3 CCC1=CC=C(C(N)=S)C=C1 CS-W010819 [0,0,0,0,1,0|2,1,0]=4 22 B11R1.3 CNC1=CC=C(C(N)=O)C=C1 CS-0927405 [0,0,0,0,1,0|2,0,0]=3 23 B11R1.3 COC1=CC=C(C(N)=O)N=C1 CS-0082328 [0,0,0,0,1,0|2,0,0]=3 24 B11R1.3 COC1=NC=C(C(C)N)C=C1 CS-0243493 [0,0,0,0,1,0|2,0,1]=4 25 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 CS-0187941 [0,0,0,0,1,0|2,0,1]=4 26 B11R1.3 COC1=NC=C([C@H](C)N)C=C1 CS-0884875 [0,0,0,0,1,0|2,0,1]=4 27 B11R1.3 CSC1=CC=C(C(C)=O)C=N1 CS-0888259 [0,0,0,0,1,0|1,1,0]=3 28 B11R1.43 COC1=NC(CC(=O)O)=CS1 CS-0851212 [0,0,0,0,1,0|3,0,0]=4 29 B13R1.3 C#CC1=CC=C(CCC(=O)O)C=C1 CS-0373286 [0,0,0,0,0,1|2,0,1]=4 30 B13R1.3 COC1=CC=C(CCC(=O)O)C=N1 CS-0037812 [0,0,0,0,0,1|2,0,0]=3 31 B13R1.3 COC1=CC=C(CCC(N)=O)C=C1 CS-0660909 [0,0,0,0,0,1|1,0,0]=2 32 B13R1.3 O=C(O)CCC1=CC=C(CO)C=C1 CS-0379577 [0,0,0,0,0,1|3,0,0]=4 33 B10R1.1 CCCC1=CC=C(Cl)C=C1 CS-0319886 [2,0,0,0,0,0|1,0,1]=4 34 B10R1.18 NC(=S)CC1=CC=CC=C1 CS-0206469 [2,0,0,0,0,0|1,1,0]=4 35 B10R1.18 O=C(O)CC1=NC=CC=C1 CS-0096299 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.3 CSC1=CC=C(CN)C=C1 CS-0206938 [2,0,0,0,0,0|1,1,0]=4 37 B10R1.3 CSC1=CC=C(CO)C=C1 CS-W014397 [2,0,0,0,0,0|0,1,1]=4 38 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 CS-W002265 [1,1,0,0,0,0|2,0,0]=4 39 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 CS-0059228 [1,1,0,0,0,0|1,0,0]=3 40 B12R1.20 CC1=CC=C(C(F)C(=O)O)C=C1 CS-0104543 [1,1,0,0,0,0|1,0,0]=3 41 B12R1.20 C[C@@H](C(=O)O)C1=CC=C(Br)C=C1 CS-0498848 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.20 O=C(O)C(F)C1=CC=C(Br)C=C1 CS-0616234 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.20 O=C(O)C(F)C1=CC=C(F)C=C1 CS-0308285 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.20 O=C(O)C(O)C1=CC=C(F)C=C1 CS-0059151 [1,1,0,0,0,0|2,0,0]=4 45 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 CS-W016914 [1,1,0,0,0,0|1,0,0]=3 46 B12R1.20 O=C(O)[C@@H](O)C1=CC=C(F)C=C1 CS-0634627 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.20 [C@H](N)(C(=O)O)C1=CC=C(F)C=C1 CS-0043796 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.49 CNC(=O)CC1=CC=C(O)C=C1 CS-0061780 [1,1,0,0,0,0|0,0,0]=2 49 B12R1.106 CP(C)(=O)CC1=CC=C(Br)C=C1 CS-0891584 [1,1,0,0,0,0|2,0,0]=4 50 B12R1.106 CS(=O)(=O)NC1=CC=C(O)C=C1 CS-0116400 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.233 CC1=CC(Br)=CC=C1CC(N)=O CS-0926580 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.233 O=C(O)CC1=C(Br)C=C(F)C=C1 CS-W005090 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.5 CCC(N)C1=CC=C(OC)C=C1 CS-0216678 [1,1,0,0,0,0|0,0,1]=3 54 B12R1.5 CCC1=CC=C(C(=O)C=O)C=C1 CS-0441475 [1,1,0,0,0,0|1,0,1]=4 55 B12R1.5 CNC(=O)C1=CC=C(OC)C=C1 CS-0061778 [1,1,0,0,0,0|1,0,1]=4 56 B12R1.5 COC1=CC=C([C@H](N)CO)C=C1 CS-0542227 [1,1,0,0,0,0|0,0,2]=4 57 B12R1.71 COC1=CC=C(\C=C\CO)C=C1 CS-0318412 [1,1,0,0,0,0|0,0,1]=3 58 B12R1.288 COC1=C(Cl)C=C(CC#N)C=C1 CS-0186401 [1,1,0,0,0,0|1,0,1]=4 59 B12R1.48 CC(=O)C1=CC=C(C#N)C(Cl)=C1 CS-0376292 [0,1,0,0,1,0|2,0,0]=4 60 B12R1.48 CCC1=C(Br)C=C(C(C)=O)C=C1 CS-0461579 [0,1,0,0,1,0|1,0,0]=3 61 B12R1.48 COC1=C(C)N=C(C(=O)O)C=C1 CS-0195565 [0,1,0,0,1,0|2,0,0]=4 62 B12R1.48 COC1=C(F)C=C([C@H](C)N)C=C1 CS-0000361 [0,1,0,0,1,0|1,0,1]=4 63 B12R1.48 COC1=C(I)N=C(C(=O)O)C=C1 CS-0308400 [0,1,0,0,1,0|2,0,0]=4 64 B12R1.48 COC1=CC=C(C(=N)N)C=C1F CS-0306045 [0,1,0,0,1,0|2,0,0]=4 65 B12R1.48 COC1=CC=C(C(C)=O)C=C1N CS-0227448 [0,1,0,0,1,0|0,0,0]=2 66 B12R1.48 COC1=CC=C([C@@H](C)O)C=C1Br CS-0251061 [0,1,0,0,1,0|0,0,2]=4 67 B12R1.256 CC(=O)C1=CC=C(C(C)C)C=C1 CS-W010857 [0,1,0,0,1,0|1,0,0]=3 68 B12R1.452 CC(=O)C1=C(Cl)C=C(C#N)C=C1 CS-0686287 [0,1,0,0,1,0|2,0,0]=4 69 B12R1.452 CCC1=CC=C(C(=O)O)C(C)=C1 CS-0775829 [0,1,0,0,1,0|2,0,0]=4 70 B12R1.452 CNC1=CC=C(C(=O)O)C(F)=C1 CS-0644200 [0,1,0,0,1,0|2,0,0]=4 71 B12R1.452 COC1=CC(C)=C([C@@H](C)N)C=C1 CS-0724363 [0,1,0,0,1,0|1,0,1]=4 72 B12R1.452 COC1=CC(Cl)=C(C(=O)O)N=C1 CS-0186810 [0,1,0,0,1,0|2,0,0]=4 73 B12R1.452 COC1=CC(Cl)=C([C@@H](C)N)C=C1 CS-0658959 [0,1,0,0,1,0|1,0,1]=4 74 B12R1.452 COC1=CC=C([C@@H](C)O)C(Br)=C1 CS-0649742 [0,1,0,0,1,0|0,0,2]=4 75 B12R1.452 COC1=CC=C([C@@H](C)O)C(F)=C1 CS-0266864 [0,1,0,0,1,0|0,0,2]=4 76 B12R1.452 COC1=CN=C(C(=O)O)C(N)=C1 CS-0094254 [0,1,0,0,1,0|2,0,0]=4 77 B12R1.452 COC1=NC(N)=C(C(=O)O)C=C1 CS-0150241 [0,1,0,0,1,0|2,0,0]=4 78 B14R1.2 CCC1=CC=C(C(C)CC(=O)O)C=C1 CS-0262252 [0,1,0,0,0,1|2,0,0]=4 79 B14R1.2 COC1=CC=C(C(=O)C=C(C)C)C=C1 CS-1184911 [0,1,0,0,0,1|1,0,1]=4 80 B14R1.2 COC1=CC=C(C(O)CC(=O)O)C=C1 CS-0511249 [0,1,0,0,0,1|1,0,0]=3 81 B14R1.3 COC1=CC=C(NC(C)C(=O)O)C=C1 CS-0700908 [0,1,0,0,0,1|1,0,0]=3 82 B14R1.5 COC1=CC=C(COC(=O)NN)C=C1 CS-0315085 [0,1,0,0,0,1|1,0,0]=3 83 B14R1.103 COC1=CC(Br)=C(CCC(=O)O)C=C1 CS-0684502 [0,1,0,0,0,1|1,0,0]=3 84 B14R1.419 CC(C)C1=CC=C(CCC(N)=O)C=C1 CS-0261577 [0,1,0,0,0,1|2,0,0]=4 85 B14R1.3653 COC1=CC=C(C#CC(=O)O)C=C1F CS-0638372 [0,1,0,0,0,1|1,0,1]=4 86 B14R1.3653 COC1=CC=C(CCC(C)=O)C=C1Br CS-0275944 [0,1,0,0,0,1|0,0,0]=2 87 B14R1.3652 COC1=CC=C(C(N)C(=O)O)C=C1C CS-0344465 [0,2,0,0,0,0|1,0,0]=3 88 B14R1.5801 CC(=O)NC1=CC=C(C(C)=O)C(O)=C1 CS-W001565 [0,2,0,0,0,0|2,0,0]=4 89 B14R1.213 CCC1=CC=C(C(C)(C)C(=O)O)C=C1 CS-B0282 [0,2,0,0,0,0|2,0,0]=4 90 B14R1.213 COC1=CC=C(C(C)(C)C(=O)O)C=C1 CS-W021413 [0,2,0,0,0,0|1,0,0]=3 91 B14R1.213 COC1=CN=C(C(F)(F)C(=O)O)C=C1 CS-0865816 [0,2,0,0,0,0|2,0,0]=4 92 B14R1.717 COC(=O)C1=CC=C(CC(C)O)C=C1 CS-1051727 [0,2,0,0,0,0|0,0,2]=4 93 B12R1.440 COC1=C(Cl)C(C(C)=O)=CC=C1 CS-0616864 [0,0,1,1,0,0|1,0,1]=4 94 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 CS-0045386 [1,0,0,1,0,0|2,0,0]=4 95 B12R2.606 CC1=NC2=C(C=CC(O)=C2)O1 CS-W021726 [1,0,0,1,0,0|2,0,0]=4 96 B12R2.606 O=C1CC2=CC(Br)=CC=C2O1 CS-0309366 [1,0,0,1,0,0|2,0,0]=4 97 B12R2.606 O=C1CC2=CC(Cl)=CC=C2O1 CS-0166883 [1,0,0,1,0,0|2,0,0]=4 98 B12R2.44 COC1=CC2=C(C=C1)NCC2 CS-0019194 [1,0,0,1,0,0|1,0,1]=4 99 B14R2.27 COC1=CC=C(C2CC(=O)C2)C=C1 CS-0216456 [0,0,0,1,0,1|0,0,0]=2 100 B14R2.134 COC1=CC2=C(C=CC(=O)N2)C=C1 CS-0136593 [0,0,0,1,0,1|1,0,1]=4 101 B14R2.2332 COC1=CC=C2NC(=O)COC2=N1 CS-0697931 [0,1,0,1,0,0|2,0,0]=4 102 B14R2.3274 COC1=CC2=C(C=C1)NC(C)=C2C CS-0531178 [0,1,0,1,0,0|2,0,0]=4 103 B14R2.329 COC1=CC=C(C(N)C2CC2)C=C1 CS-W007281 [0,1,0,1,0,0|1,0,1]=4 104 B14R2.1815 COC1=CC2=C(C=C1)N(C)C(C)=N2 CS-0908237 [0,1,0,1,0,0|2,0,0]=4 105 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 CS-0222820 [1,0,0,0,1,0|0,0,2]=4 106 B10R1.13 CN(C)C1=CC=C(O)C=C1 CS-0037689 [1,0,0,0,1,0|2,0,0]=4 107 B10R1.13 C[C@H](N)C1=CC=C(O)C=C1 CS-0103184 [1,0,0,0,1,0|1,0,1]=4 108 B10R1.13 O=C(O)C1=CC=C(I)C=C1 CS-W014112 [1,0,0,0,1,0|2,0,0]=4 109 B10R1.54 CC(=O)CC1=NC=C(C)O1 CS-0255939 [1,0,0,0,1,0|2,0,0]=4 110 B10R1.31 COC1=CSC(C(=O)O)=C1 CS-0434710 [0,0,0,0,2,0|2,0,0]=4 111 B12R1.21 C=C(C)COC1=CC=C(Br)C=C1 CS-0911945 [1,0,0,0,0,1|2,0,0]=4 112 B12R1.21 CC(=O)\C=C\C1=NC=C(C)C=C1 CS-0324353 [1,0,0,0,0,1|1,0,1]=4 113 B12R1.21 CC(N)CCC1=CC=C(O)C=C1 CS-0453287 [1,0,0,0,0,1|1,0,1]=4 114 B12R1.21 NC(=O)CNC1=CC=C(F)C=C1 CS-0927443 [1,0,0,0,0,1|2,0,0]=4 115 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 CS-0199636 [1,0,0,0,0,1|2,0,0]=4 116 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 CS-0201679 [1,0,0,0,0,1|1,0,0]=3