0 B14R2.22 CC1=CC=CC(C2=CSC(N)=N2)=C1 CS-0217599 [0,0,0,0,0,0|1,1,2]=4 1 B14R2.22 N=C1N=C(C2=CC(F)=CC=C2)NN1 CS-0269148 [0,0,0,0,0,0|2,0,2]=4 2 B14R2.22 NC1=CC(C2=CC(Cl)=CC=C2)=NO1 CS-0456540 [0,0,0,0,0,0|2,1,1]=4 3 B14R2.22 NC1=CC(C2=CC(O)=CC=C2)=NO1 CS-0269196 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.22 NC1=CC(C2=CC=CC(F)=C2)=NO1 CS-0044492 [0,0,0,0,0,0|2,0,1]=3 5 B14R2.22 NC1=CC=CC(C2=CSC(N)=N2)=C1 CS-0684734 [0,0,0,0,0,0|1,1,2]=4 6 B14R2.22 NC1=NC(C2=CC(F)=CC=C2)=CS1 CS-0206369 [0,0,0,0,0,0|0,1,2]=3 7 B14R2.22 NC1=NC(C2=CC(O)=CC=C2)=CS1 CS-0139266 [0,0,0,0,0,0|1,1,2]=4 8 B14R2.22 NC1=NC(C2=CC=CC(Br)=C2)=CS1 CS-W002466 [0,0,0,0,0,0|0,2,2]=4 9 B14R2.22 NC1=NC(C2=CC=CC(Cl)=C2)=CS1 CS-0136618 [0,0,0,0,0,0|0,2,2]=4 10 B14R2.22 NC1=NNC(C2=CC=CC(F)=C2)=C1 CS-0044488 [0,0,0,0,0,0|3,0,1]=4 11 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 CS-0126655 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 CS-W017937 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.10 NC1=NC(C2=CC=CC=C2)=CO1 CS-0046180 [1,0,0,0,0,0|0,0,2]=3 14 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 CS-W017405 [1,0,0,0,0,0|0,1,2]=4 15 B13R2.10 NC1=NC(C2=CC=CC=C2)=NS1 CS-0074158 [1,0,0,0,0,0|1,1,1]=4 16 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 CS-0060554 [1,0,0,0,0,0|2,0,1]=4 17 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 CS-0127236 [1,0,0,0,0,0|2,0,0]=3 18 B13R2.10 NC1=NOC(C2=CC=CC=C2)=N1 CS-0213058 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 CS-W018637 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.10 O=C1CCC(C2=CC=CC=C2)C1 CS-0139334 [1,0,0,0,0,0|3,0,0]=4 21 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)N1 CS-0098324 [1,0,0,0,0,0|2,0,1]=4 22 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 CS-0043875 [1,0,0,0,0,0|2,0,1]=4 23 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 CS-0039132 [1,0,0,0,0,0|1,0,1]=3 24 B13R2.10 O=C1NC(C2=CC=CC=C2)CS1 CS-0050784 [1,0,0,0,0,0|1,1,1]=4 25 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 CS-0455553 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0031471 [1,0,0,0,0,0|1,0,1]=3 27 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017924 [1,0,0,0,0,0|1,0,1]=3 28 B13R2.10 O=C1OCC(C2=CC=CC=C2)O1 CS-0697972 [1,0,0,0,0,0|2,0,0]=3 29 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0093692 [1,0,0,0,0,0|1,0,1]=3 30 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 CS-0093691 [1,0,0,0,0,0|1,1,1]=4 31 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017256 [1,0,0,0,0,0|1,0,1]=3 32 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 CS-0053184 [1,0,0,0,0,0|1,1,1]=4 33 B13R2.13 FC1=CC(C2CCCN2)=CC=C1 CS-W021391 [1,0,0,0,0,0|1,0,2]=4 34 B13R2.13 FC1=CC([C@@H]2CCCN2)=CC=C1 CS-0138162 [1,0,0,0,0,0|1,0,2]=4 35 B13R2.13 FC1=CC([C@H]2CCCN2)=CC=C1 CS-0008669 [1,0,0,0,0,0|1,0,2]=4 36 B13R2.13 FC1=CC=CC(C2=NNC=N2)=C1 CS-0210481 [1,0,0,0,0,0|2,0,1]=4 37 B13R2.13 NC1=CC=CC(C2=COC=N2)=C1 CS-0269167 [1,0,0,0,0,0|1,0,2]=4 38 B15R2.14 FC1=CC(C2=NOC(CCl)=N2)=CC=C1 CS-0209620 [0,1,0,0,0,0|2,0,1]=4 39 B15R2.14 NCC1=NC(C2=CC=CC(Br)=C2)=NO1 CS-0123086 [0,1,0,0,0,0|1,1,1]=4 40 B15R2.14 NCC1=NC(C2=CC=CC(F)=C2)=NO1 CS-0458797 [0,1,0,0,0,0|1,0,1]=3 41 B15R2.290 NC1=NC(C2=C(F)C=CC(F)=C2)=CS1 CS-0452002 [0,1,0,0,0,0|0,1,2]=4 42 B15R2.299 NC1=CC(C2=CC=C(F)C(F)=C2)=NO1 CS-0038164 [0,1,0,0,0,0|2,0,1]=4 43 B15R2.299 O=C1CC(C2=CC=C(F)C(F)=C2)CN1 CS-0262878 [0,1,0,0,0,0|3,0,0]=4 44 B13R1.15 COC(=O)CCC1=CC(F)=CC=C1 CS-0452462 [0,0,1,0,0,0|2,0,0]=3 45 B13R1.15 COC(=O)CCC1=CC=CC(Br)=C1 CS-W022812 [0,0,1,0,0,0|2,1,0]=4 46 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 CS-0131489 [0,0,1,0,0,0|3,0,0]=4 47 B13R1.147 NC(CC(=O)O)C1=CC(F)=CC=C1 CS-W002674 [0,0,1,0,0,0|3,0,0]=4 48 B15R2.28 O=C1CCC(C2=CC(F)=CC=C2)CC1 CS-0186864 [0,0,0,0,0,1|3,0,0]=4 49 B15R2.1115 NC1=NC(CC2=CC=CC(F)=C2)=NN1 CS-0181126 [0,0,0,0,0,1|2,0,1]=4 50 B15R2.1115 NC1=NN(CC2=CC=CC(F)=C2)C=N1 CS-0240513 [0,0,0,0,0,1|2,0,1]=4 51 B12R1.27 COC(=O)CCC1=CC=CC=C1 CS-W007828 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.27 COC(=O)NCC1=CC=CC=C1 CS-0150648 [1,0,1,0,0,0|1,0,1]=4 53 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 CS-W017812 [1,0,1,0,0,0|2,0,0]=4 54 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 CS-W017905 [1,0,1,0,0,0|2,0,0]=4 55 B12R1.107 CC(NC(N)=S)C1=CC=CC=C1 CS-0212957 [1,0,1,0,0,0|0,1,1]=4 56 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 CS-0066979 [1,0,1,0,0,0|2,0,0]=4 57 B14R1.135 COC(=O)C(N)CC1=CC=CC(F)=C1 CS-0527418 [0,1,1,0,0,0|2,0,0]=4 58 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 CS-0022311 [1,1,0,0,0,0|1,0,1]=4 59 B14R2.4476 O=C(O)[C@@H]1C[C@H]1C2=CC=CC(F)=C2 CS-0044563 [0,0,1,1,0,0|2,0,0]=4 60 B12R1.50 COC(=O)CC1=CC(N)=CC=C1 CS-W004989 [0,0,1,0,1,0|2,0,0]=4 61 B12R1.50 COC(=O)CC1=CC=CC(Br)=C1 CS-W019829 [0,0,1,0,1,0|1,1,0]=4 62 B12R1.50 COC(=O)CC1=CC=CC(C)=C1 CS-0088535 [0,0,1,0,1,0|2,0,0]=4 63 B12R1.50 COC(=O)CC1=CC=CC(Cl)=C1 CS-0088560 [0,0,1,0,1,0|1,1,0]=4 64 B12R1.50 COC(=O)CC1=CC=CC(F)=C1 CS-0088534 [0,0,1,0,1,0|1,0,0]=3 65 B12R1.50 COC(=O)CC1=CC=CC(I)=C1 CS-0181582 [0,0,1,0,1,0|1,1,0]=4 66 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 CS-0019183 [0,0,1,0,1,0|2,0,0]=4 67 B12R1.50 COC(=O)CC1=NC(F)=CC=C1 CS-0194190 [0,0,1,0,1,0|2,0,0]=4 68 B12R1.225 CC(C(=O)O)C1=CC(Br)=CC=C1 CS-0209873 [0,0,1,0,1,0|1,1,0]=4 69 B12R1.225 CC(C(=O)O)C1=CC(F)=CC=C1 CS-0466093 [0,0,1,0,1,0|1,0,0]=3 70 B12R1.225 CC1=CC=CC([C@@H](C)C(=O)O)=C1 CS-0139530 [0,0,1,0,1,0|2,0,0]=4 71 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 CS-0162201 [0,0,1,0,1,0|2,0,0]=4 72 B12R1.225 O=C(O)C(O)C1=CC(F)=CC=C1 CS-0156912 [0,0,1,0,1,0|2,0,0]=4 73 B12R2.22 NC1CC(C2=CC=CC=C2)C1 CS-0051224 [1,0,0,0,1,0|1,0,1]=4 74 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 CS-0184265 [1,0,0,0,1,0|1,0,1]=4 75 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 CS-0054863 [1,0,0,0,1,0|2,0,0]=4 76 B12R2.23 O=C1CCC1C2=CC=CC=C2 CS-0051808 [1,0,0,0,1,0|2,0,0]=4 77 B12R2.80 NC1CC1C2=CC=CC(F)=C2 CS-0162891 [0,0,0,0,2,0|0,0,1]=3 78 B12R2.80 N[C@@H]1C[C@H]1C2=CC(Br)=CC=C2 CS-0528597 [0,0,0,0,2,0|0,1,1]=4 79 B14R2.19 O=C1NC(CC2=CC=CC=C2)CO1 CS-0452270 [1,0,0,0,0,1|1,0,1]=4 80 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-D1593 [1,0,0,0,0,1|1,0,1]=4 81 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W007664 [1,0,0,0,0,1|1,0,1]=4 82 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-W010677 [1,0,0,0,0,1|1,0,1]=4 83 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W010678 [1,0,0,0,0,1|1,0,1]=4 84 B14R2.68 O=C1CN[C@@H](C2=CC=CC=C2)CO1 CS-0016547 [1,0,0,0,0,1|1,0,1]=4 85 B14R2.68 O=C1CN[C@H](C2=CC=CC=C2)CO1 CS-0442401 [1,0,0,0,0,1|1,0,1]=4