0 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 CS-0022301 [0,0,0,0,0,0|4,0,0]=4 1 B14R2.19 NC1=NC=C(CC2=CC=CC=C2)S1 CS-0442767 [0,0,0,0,0,0|2,0,2]=4 2 B14R2.19 NC1=NN(CC2=CC=CC=C2)C=C1 CS-0122664 [0,0,0,0,0,0|2,0,1]=3 3 B14R2.19 NC1=NNC(CC2=CC=CC=C2)=C1 CS-0085450 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.19 NC1=NOC(CC2=CC=CC=C2)=C1 CS-0310866 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.19 NC1CCN(CC2=CC=CC=C2)C1 CS-W017396 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.19 N[C@@H]1CCN(CC2=CC=CC=C2)C1 CS-0013276 [0,0,0,0,0,0|3,0,1]=4 7 B14R2.19 N[C@H]1CCN(CC2=CC=CC=C2)C1 CS-W002342 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 CS-W001967 [0,0,0,0,0,0|4,0,0]=4 9 B14R2.19 O=C1NC(CC2=CC=CC=C2)CO1 CS-0452270 [0,0,0,0,0,0|1,0,1]=2 10 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-D1593 [0,0,0,0,0,0|1,0,1]=2 11 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W007664 [0,0,0,0,0,0|1,0,1]=2 12 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 CS-W010677 [0,0,0,0,0,0|1,0,1]=2 13 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CS1 CS-W015151 [0,0,0,0,0,0|1,1,1]=3 14 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 CS-W010678 [0,0,0,0,0,0|1,0,1]=2 15 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 CS-W015150 [0,0,0,0,0,0|1,1,1]=3 16 B13R2.64 C1=CC=C(CC2=NC=CN2)C=C1 CS-W018628 [1,0,0,0,0,0|2,0,1]=4 17 B13R2.64 C1=CC=C(CC2CCCN2)C=C1 CS-0067945 [1,0,0,0,0,0|1,0,2]=4 18 B13R2.64 C1=CC=C(CN2C=CC=N2)C=C1 CS-0206428 [1,0,0,0,0,0|2,0,1]=4 19 B13R2.64 C1=CC=C(CN2C=NC=N2)C=C1 CS-0432874 [1,0,0,0,0,0|2,0,1]=4 20 B13R2.64 C1=CC=C(CN2CC=CC2)C=C1 CS-W001618 [1,0,0,0,0,0|3,0,0]=4 21 B15R2.98 NC1=NN(CC2=CC=C(Cl)C=C2)C=N1 CS-0265589 [0,1,0,0,0,0|2,0,1]=4 22 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 CS-W022769 [0,1,0,0,0,0|1,0,2]=4 23 B15R2.1115 NC1=NC(CC2=CC=CC(F)=C2)=NN1 CS-0181126 [0,1,0,0,0,0|2,0,1]=4 24 B15R2.1115 NC1=NN(CC2=CC=CC(F)=C2)C=N1 CS-0240513 [0,1,0,0,0,0|2,0,1]=4 25 B13R1.337 CC(=O)OCCCC1=CC=CC=C1 CS-0196601 [0,0,1,0,0,0|2,0,0]=3 26 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 CS-0156332 [0,0,1,0,0,0|3,0,0]=4 27 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 CS-0059946 [0,0,1,0,0,0|3,0,0]=4 28 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 CS-0186132 [0,0,1,0,0,0|3,0,0]=4 29 B13R1.348 [C@@H](N)(CC(=O)O)CC1=CC=CC=C1 CS-W013167 [0,0,1,0,0,0|3,0,0]=4 30 B13R1.718 COC(=O)CCCC1=CC=CC=C1 CS-D0496 [0,0,1,0,0,0|2,0,0]=3 31 B13R1.718 COC(=O)CCNC1=CC=CC=C1 CS-0150687 [0,0,1,0,0,0|3,0,0]=4 32 B13R1.718 COC(=O)CNCC1=CC=CC=C1 CS-W022790 [0,0,1,0,0,0|3,0,0]=4 33 B13R1.718 COC(=O)COCC1=CC=CC=C1 CS-0136691 [0,0,1,0,0,0|3,0,0]=4 34 B15R3.2009 [C@@H]12NC(=O)O[C@@H]1CC3=C2C=CC=C3 CS-0098288 [0,0,0,1,0,0|3,0,0]=4 35 B15R3.2009 [C@H]12CC3=C(C=CC=C3)[C@H]1NC(=O)O2 CS-0093685 [0,0,0,1,0,0|3,0,0]=4 36 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 CS-0126655 [0,0,0,0,1,0|2,0,1]=4 37 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 CS-W017937 [0,0,0,0,1,0|2,0,1]=4 38 B13R2.10 NC1=NC(C2=CC=CC=C2)=CO1 CS-0046180 [0,0,0,0,1,0|0,0,2]=3 39 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 CS-W017405 [0,0,0,0,1,0|0,1,2]=4 40 B13R2.10 NC1=NC(C2=CC=CC=C2)=NS1 CS-0074158 [0,0,0,0,1,0|1,1,1]=4 41 B13R2.10 NC1=NN(C2=CC=CC=C2)C=C1 CS-0060554 [0,0,0,0,1,0|2,0,1]=4 42 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 CS-0127236 [0,0,0,0,1,0|2,0,0]=3 43 B13R2.10 NC1=NOC(C2=CC=CC=C2)=N1 CS-0213058 [0,0,0,0,1,0|2,0,1]=4 44 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 CS-W018637 [0,0,0,0,1,0|3,0,0]=4 45 B13R2.10 O=C1CCC(C2=CC=CC=C2)C1 CS-0139334 [0,0,0,0,1,0|3,0,0]=4 46 B13R2.10 O=C1CC[C@H](C2=CC=CC=C2)N1 CS-0098324 [0,0,0,0,1,0|2,0,1]=4 47 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 CS-0043875 [0,0,0,0,1,0|2,0,1]=4 48 B13R2.10 O=C1NC(C2=CC=CC=C2)CO1 CS-0039132 [0,0,0,0,1,0|1,0,1]=3 49 B13R2.10 O=C1NC(C2=CC=CC=C2)CS1 CS-0050784 [0,0,0,0,1,0|1,1,1]=4 50 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 CS-0455553 [0,0,0,0,1,0|3,0,0]=4 51 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0031471 [0,0,0,0,1,0|1,0,1]=3 52 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017924 [0,0,0,0,1,0|1,0,1]=3 53 B13R2.10 O=C1OCC(C2=CC=CC=C2)O1 CS-0697972 [0,0,0,0,1,0|2,0,0]=3 54 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 CS-0093692 [0,0,0,0,1,0|1,0,1]=3 55 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 CS-0093691 [0,0,0,0,1,0|1,1,1]=4 56 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CO1 CS-W017256 [0,0,0,0,1,0|1,0,1]=3 57 B13R2.10 S=C1N[C@H](C2=CC=CC=C2)CS1 CS-0053184 [0,0,0,0,1,0|1,1,1]=4 58 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 CS-0052597 [0,0,0,0,1,0|2,0,1]=4 59 B13R2.31 NC1CN(CC2=CC=CC=C2)C1 CS-0183208 [0,0,0,0,1,0|2,0,1]=4 60 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 CS-W001898 [0,0,0,0,0,1|3,0,0]=4 61 B15R2.283 NC1=NC(SCC2=CC=CC=C2)=NS1 CS-0220158 [0,0,0,0,0,1|1,1,1]=4 62 B12R1.8 NCCCCCC1=CC=CC=C1 CS-0096226 [1,0,1,0,0,0|1,0,1]=4 63 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 CS-0431735 [1,0,1,0,0,0|0,0,2]=4 64 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 CS-0669236 [1,0,1,0,0,0|0,0,2]=4 65 B12R1.118 CN[C@H](CO)CC1=CC=CC=C1 CS-0151245 [1,0,1,0,0,0|0,0,2]=4 66 B12R1.252 O=C(O)CCCC1=CC=CC=C1 CS-D1686 [1,0,1,0,0,0|2,0,0]=4 67 B14R1.549 CC(=O)N[C@H](CO)CC1=CC=CC=C1 CS-0137204 [0,1,1,0,0,0|1,0,1]=4 68 B14R1.13 COC(=O)CCCC1=CC=C(Br)C=C1 CS-0342438 [0,1,1,0,0,0|2,0,0]=4 69 B14R1.13 COC(=O)CCCC1=CC=C(N)C=C1 CS-W005992 [0,1,1,0,0,0|2,0,0]=4 70 B14R1.520 CCOC(=O)CCCC1=CC=CC=C1 CS-W010703 [0,1,1,0,0,0|2,0,0]=4 71 B14R1.756 COC(=O)C(N)CCC1=CC=CC=C1 CS-0084236 [0,1,1,0,0,0|2,0,0]=4 72 B14R1.756 COC(=O)[C@@H](N)CCC1=CC=CC=C1 CS-0210545 [0,1,1,0,0,0|2,0,0]=4 73 B14R2.8 NCC1=NC(C2=CC=CC=C2)=NO1 CS-0022311 [0,1,0,0,1,0|1,0,1]=4 74 B16R2.2903 CC1(C)OC(=O)N[C@@H]1CC2=CC=CC=C2 CS-0098462 [0,2,0,0,0,0|1,0,1]=4 75 B14R2.768 O=C(O)CC1CC2=CC=CC=C2C1 CS-W007054 [0,0,1,1,0,0|2,0,0]=4 76 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O CS-0106156 [0,0,1,0,1,0|1,0,0]=3 77 B12R1.43 CC(OC1=CC=CC=C1)C(=O)O CS-W021018 [0,0,1,0,1,0|2,0,0]=4 78 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 CS-W007567 [0,0,1,0,1,0|1,0,1]=4 79 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 CS-0149997 [0,0,1,0,1,0|1,0,1]=4 80 B12R1.43 NC(CC1=CC=CC=C1)C(=O)O CS-W018529 [0,0,1,0,1,0|2,0,0]=4 81 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O CS-2315 [0,0,1,0,1,0|2,0,0]=4 82 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O CS-W020009 [0,0,1,0,1,0|2,0,0]=4 83 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 CS-0060520 [0,0,1,0,1,0|2,0,0]=4 84 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 CS-W017878 [0,0,1,0,1,0|2,0,0]=4 85 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 CS-W020023 [0,0,1,0,1,0|2,0,0]=4 86 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 CS-W020670 [0,0,1,0,1,0|2,0,0]=4 87 B12R1.43 [C@H](Br)(CC1=CC=CC=C1)C(=O)O CS-W012984 [0,0,1,0,1,0|2,0,0]=4 88 B12R1.43 [C@H](N)(CC1=CC=CC=C1)C(=N)O CS-W015584 [0,0,1,0,1,0|1,0,1]=4 89 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 CS-W017905 [0,0,1,0,1,0|2,0,0]=4 90 B12R1.107 CC(NC(N)=S)C1=CC=CC=C1 CS-0212957 [0,0,1,0,1,0|0,1,1]=4 91 B12R1.107 C[C@H](CC(=O)O)C1=CC=CC=C1 CS-0066979 [0,0,1,0,1,0|2,0,0]=4 92 B12R1.27 COC(=O)CCC1=CC=CC=C1 CS-W007828 [0,0,1,0,1,0|1,0,0]=3 93 B12R1.27 COC(=O)CCC1=CC=CC=N1 CS-0150699 [0,0,1,0,1,0|2,0,0]=4 94 B12R1.27 COC(=O)CCC1=CC=NC=C1 CS-0213157 [0,0,1,0,1,0|2,0,0]=4 95 B12R1.27 COC(=O)CCC1=CN=CC=C1 CS-0150698 [0,0,1,0,1,0|2,0,0]=4 96 B12R1.27 COC(=O)COC1=CC=CC=C1 CS-W016060 [0,0,1,0,1,0|2,0,0]=4 97 B12R1.27 COC(=O)CSC1=CC=CC=C1 CS-W017097 [0,0,1,0,1,0|2,0,0]=4 98 B12R1.27 COC(=O)NCC1=CC=CC=C1 CS-0150648 [0,0,1,0,1,0|1,0,1]=4 99 B12R2.22 NC1CC(C2=CC=CC=C2)C1 CS-0051224 [0,0,0,0,2,0|1,0,1]=4 100 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 CS-0184265 [0,0,0,0,2,0|1,0,1]=4 101 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 CS-0054863 [0,0,0,0,2,0|2,0,0]=4 102 B12R2.23 O=C1CCC1C2=CC=CC=C2 CS-0051808 [0,0,0,0,2,0|2,0,0]=4 103 B14R2.101 C1=CC=C(COC2CC=CC2)C=C1 CS-0139620 [1,0,0,0,0,1|2,0,0]=4