0 B12R2.612 CC1=CC=C2B(O)OCC2=C1 CS-0078582 [0,0,0,0,0,0|1,0,0]=1 1 B12R2.612 FC1=CC2=C(C=C1)C(Cl)=NN2 CS-0051405 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.612 NC1=CC2=C(C=C1)C(O)=NN2 CS-0038777 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.612 NC1=CC=C2B(O)OCC2=C1 CS-0078594 [0,0,0,0,0,0|1,0,0]=1 4 B12R2.612 NC1=CC=C2C(=O)CCC2=C1 CS-W008688 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 CS-0104999 [0,0,0,0,0,0|3,1,0]=4 6 B12R2.612 O=C1COC2=CC(F)=CC=C12 CS-0105957 [0,0,0,0,0,0|3,0,1]=4 7 B12R2.612 O=C1NCC2=C1C=CC(Cl)=C2 CS-D0305 [0,0,0,0,0,0|2,1,1]=4 8 B12R2.612 OB1OCC2=C1C=CC(O)=C2 CS-0052741 [0,0,0,0,0,0|1,0,0]=1 9 B12R2.612 OC1=NSC2=C1C=CC(F)=C2 CS-0060655 [0,0,0,0,0,0|3,0,0]=3 10 B11R2.1 OC1CCC2=C1C=CC=N2 CS-0060663 [1,0,0,0,0,0|3,0,0]=4 11 B11R2.1 O[C@H]1CCC2=C1C=CC=N2 CS-0069940 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.1 O[C@H]1CCC2=C1C=CN=C2 CS-0069933 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.36 BrC1=CC2=C(C=CC2)C=C1 CS-W019162 [1,0,0,0,0,0|2,1,0]=4 14 B11R2.36 ClC1=CC=C2OCCC2=C1 CS-0060211 [1,0,0,0,0,0|2,1,0]=4 15 B11R2.36 FC1=CC2=C(C=C1)COC2 CS-0094677 [1,0,0,0,0,0|1,0,0]=2 16 B11R2.36 FC1=CC2=C(C=C1)OC=N2 CS-0060653 [1,0,0,0,0,0|3,0,0]=4 17 B11R2.36 FC1=CC2=NON=C2C=C1 CS-0086143 [1,0,0,0,0,0|2,0,0]=3 18 B11R2.36 NC1=CC2=C(C=C1)CNC2 CS-0092035 [1,0,0,0,0,0|3,0,0]=4 19 B11R2.36 NC1=CC=C2CCCC2=C1 CS-0088459 [1,0,0,0,0,0|3,0,0]=4 20 B11R2.36 NC1=CC=C2OCCC2=C1 CS-B1174 [1,0,0,0,0,0|3,0,0]=4 21 B11R2.36 OC1=CC2=C(C=C1)CNC2 CS-0055008 [1,0,0,0,0,0|3,0,0]=4 22 B11R2.36 OC1=CN=C2COCC2=C1 CS-0069881 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.2130 COC1=CC=C2B(O)OCC2=C1 CS-0078596 [0,1,0,0,0,0|1,0,0]=2 24 B13R2.2130 COC1=CC=C2C(=O)OCC2=C1 CS-0036954 [0,1,0,0,0,0|2,0,1]=4 25 B13R2.2130 N#CC1=CC=C2B(O)OCC2=C1 CS-0100853 [0,1,0,0,0,0|1,0,0]=2 26 B13R2.2130 NCC1=CC=C2B(O)OCC2=C1 CS-0093698 [0,1,0,0,0,0|1,0,0]=2 27 B13R2.2130 OCC1=CC=C2B(O)OCC2=C1 CS-0079302 [0,1,0,0,0,0|1,0,0]=2 28 B13R2.3108 CC1(C)OCC2=C1C=CC(N)=C2 CS-0104529 [0,1,0,0,0,0|3,0,0]=4 29 B13R2.5180 CC1=C2COC(=O)C2=CC=C1Br CS-0058102 [0,1,0,0,0,0|1,1,1]=4 30 B13R2.5180 O=C1CCC2=C1C=CC(F)=C2F CS-W009081 [0,1,0,0,0,0|2,0,1]=4 31 B11R1.22 O[C@H](CCl)C1=CC=C(F)C=C1 CS-0062157 [0,0,1,0,0,0|3,0,0]=4 32 B11R1.24 OCCCC1=CC=CC(F)=C1 CS-0111676 [0,0,1,0,0,0|2,0,0]=3 33 B11R1.166 CC1=CC(O)=C(B(O)O)C=C1 CS-0049769 [0,0,1,0,0,0|2,0,0]=3 34 B11R1.166 CC1=CC=C(B(O)O)C(F)=N1 CS-0109931 [0,0,1,0,0,0|3,0,0]=4 35 B11R1.166 OB(O)C1=C(F)C=C(Cl)N=C1 CS-0109710 [0,0,1,0,0,0|2,1,0]=4 36 B11R1.166 OB(O)C1=CC=C(Br)N=C1F CS-0109850 [0,0,1,0,0,0|2,1,0]=4 37 B11R1.166 OB(O)C1=CC=C(Cl)C=C1O CS-0112194 [0,0,1,0,0,0|1,1,0]=3 38 B11R1.166 OB(O)C1=CC=C(Cl)N=C1F CS-0109927 [0,0,1,0,0,0|2,1,0]=4 39 B13R2.5179 O=C1NCCC2=CC(F)=CC=C12 CS-0036315 [0,0,0,0,0,1|2,0,1]=4 40 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 CS-0109932 [1,0,1,0,0,0|1,1,0]=4 41 B10R1.15 COC(=N)C1=CC=CC=C1 CS-0037087 [1,0,1,0,0,0|2,0,0]=4 42 B10R1.10 CC1=CC(CCO)=CC=C1 CS-0038545 [1,0,1,0,0,0|2,0,0]=4 43 B10R1.10 CC1=CC(CON)=CC=C1 CS-0080701 [1,0,1,0,0,0|2,0,0]=4 44 B10R1.10 NNCC1=CC(F)=CC=C1 CS-0053051 [1,0,1,0,0,0|2,0,0]=4 45 B10R1.10 O=CCC1=CC(F)=CC=C1 CS-0038688 [1,0,1,0,0,0|1,0,1]=4 46 B10R1.17 C=COCC1=CC=CC=C1 CS-0049793 [1,0,1,0,0,0|2,0,0]=4 47 B10R1.20 OCC1=C(CO)C=NC=C1 CS-0052985 [1,0,1,0,0,0|2,0,0]=4 48 B10R1.20 OCC1=C(CO)C=NC=C1 CS-0052986 [1,0,1,0,0,0|2,0,0]=4 49 B10R1.20 OCC1=C(CO)N=CC=C1 CS-0060368 [1,0,1,0,0,0|2,0,0]=4 50 B10R1.20 OCC1=C(CO)N=CC=C1 CS-0060369 [1,0,1,0,0,0|2,0,0]=4 51 B10R1.25 NC1=CC=C(CO)C(O)=C1 CS-0103176 [1,0,1,0,0,0|2,0,0]=4 52 B10R1.30 NC1=CC=C(Cl)C(CO)=C1 CS-0060202 [1,0,1,0,0,0|2,0,0]=4 53 B10R1.30 OCC1=CC(F)=CC=C1I CS-0037691 [1,0,1,0,0,0|1,0,0]=3 54 B10R1.61 O=C1NC=CC=C1B(O)O CS-0053509 [1,0,1,0,0,0|2,0,0]=4 55 B12R1.12 COC(OC)C1=CC=C(C)C=C1 CS-0101971 [0,1,1,0,0,0|2,0,0]=4 56 B12R1.1703 COC(=O)C1=CC=C(F)C=C1I CS-0062063 [0,1,1,0,0,0|1,0,1]=4 57 B12R1.46 OCC1=CC=C(F)C=C1B(O)O CS-0044908 [0,1,1,0,0,0|2,0,0]=4 58 B12R1.57 O=[N+]([O-])C1=C(CO)C=C(F)C=C1 CS-W003267 [0,1,1,0,0,0|1,0,1]=4 59 B12R1.232 CC1=CC(F)=C(Br)C=C1C(=O)O CS-0112810 [0,1,1,0,0,0|1,0,1]=4 60 B12R1.232 CC1=CC(F)=C(F)C=C1B(O)O CS-B1253 [0,1,1,0,0,0|0,0,0]=2 61 B12R1.232 OB(O)C1=CC(F)=C(O)C=C1F CS-0112418 [0,1,1,0,0,0|2,0,0]=4 62 B12R1.452 CC1=CC(C=O)=CC=C1B(O)O CS-0061263 [0,1,1,0,0,0|1,0,0]=3 63 B12R1.893 OB(O)C1=C(F)C(F)=C(Br)C=C1 CS-0060311 [0,1,1,0,0,0|1,1,0]=4 64 B12R1.893 OB(O)C1=CC=C(Cl)C(Br)=C1Cl CS-0111818 [0,1,1,0,0,0|1,1,0]=4 65 B12R1.1000 OB(O)C1=C(Cl)C=C(Cl)C=C1Br CS-0111820 [0,1,1,0,0,0|1,1,0]=4 66 B12R1.1000 OB(O)C1=C(Cl)C=C(F)C=C1Cl CS-0060175 [0,1,1,0,0,0|1,0,0]=3 67 B12R2.132 CC1=CC=C2COB(O)C2=C1 CS-0093708 [1,1,0,0,0,0|0,0,0]=2 68 B12R2.132 NC1=CC=C2COB(O)C2=C1 CS-0078609 [1,1,0,0,0,0|0,0,0]=2 69 B12R2.132 NC1=CC=C2COB(O)C2=C1 CS-0100861 [1,1,0,0,0,0|0,0,0]=2 70 B12R2.132 NC1=CC=C2COC(=O)C2=C1 CS-0036733 [1,1,0,0,0,0|1,0,1]=4 71 B12R2.132 OB1OCC2=CC=C(Cl)C=C12 CS-0078613 [1,1,0,0,0,0|0,0,0]=2 72 B12R2.132 OB1OCC2=CC=C(S)C=C12 CS-0079300 [1,1,0,0,0,0|0,0,0]=2 73 B12R2.196 CC1=C2COB(O)C2=CC=C1 CS-0078585 [1,1,0,0,0,0|0,0,0]=2 74 B12R2.196 NC1=C2COB(O)C2=CC=C1 CS-0078592 [1,1,0,0,0,0|0,0,0]=2 75 B12R2.196 NC1=C2COC(=O)C2=CC=C1 CS-0064854 [1,1,0,0,0,0|1,0,1]=4 76 B12R2.196 O[C@H]1CCC2=C1C=CC=C2Br CS-0047467 [1,1,0,0,0,0|2,0,0]=4 77 B12R2.203 CC1=C2B(O)OCC2=CC=C1 CS-0078584 [1,1,0,0,0,0|0,0,0]=2 78 B12R2.203 NC1=C2B(O)OCC2=CC=C1 CS-0078590 [1,1,0,0,0,0|0,0,0]=2 79 B12R2.203 OB1OCC2=CC=CC(F)=C12 CS-0093707 [1,1,0,0,0,0|0,0,0]=2 80 B12R2.2028 CC1OB(O)C2=CC=CC=C21 CS-0078583 [1,1,0,0,0,0|0,0,0]=2 81 B12R2.82 CC1=C(N)C=CC2=C1COC2 CS-0094772 [1,1,0,0,0,0|2,0,0]=4 82 B12R2.82 NC1=C(I)C2=C(C=C1)COC2 CS-0093502 [1,1,0,0,0,0|2,0,0]=4 83 B12R2.100 CC1=CC2=C(C=C1N)COC2 CS-0093505 [1,1,0,0,0,0|2,0,0]=4 84 B12R2.100 NC1=CC2=C(C=C1Cl)COC2 CS-0094310 [1,1,0,0,0,0|1,1,0]=4 85 B12R2.100 NC1=CC2=C(C=C1F)COC2 CS-0094308 [1,1,0,0,0,0|1,0,0]=3 86 B12R2.100 NC1=CC2=C(C=C1I)COC2 CS-0094682 [1,1,0,0,0,0|1,1,0]=4 87 B14R2.28480 O[C@H]1CCOC2=CC(F)=CC(F)=C21 CS-0100733 [0,1,0,0,0,1|2,0,0]=4 88 B14R2.5719 O=C(O)C1=CC=C2B(O)OCC2=C1 CS-0078618 [0,2,0,0,0,0|1,0,0]=3 89 B14R2.8731 O=C1OC(O)C2=C1C=CC(F)=C2F CS-0063615 [0,2,0,0,0,0|1,0,1]=4 90 B10R1.59 CC1=CC(B(O)O)=C(C)S1 CS-0038853 [0,0,1,0,1,0|2,0,0]=4