0 B14R2.5637 CC1CNCCC2=C1C=C(Cl)C=C2 AC020404 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.5637 CC1CNCCC2=CC=C(Cl)C=C12 AC021362 [0,0,0,0,0,0|0,0,0]=0 2 B14R2.5637 C[C@H]1CNCCC2=CC=C(Cl)C=C12 HY-15368 [0,0,0,0,0,0|0,0,0]=0 3 B14R2.5637 ClC1=CC=C2NCCCC(=O)C2=C1 AC182033 [0,0,0,0,0,0|3,0,1]=4 4 B13R2.3729 ClC1=CC=C2NCCCCC2=C1 AC210014 [1,0,0,0,0,0|2,0,0]=3 5 B13R2.162 BrC1=CC2=C(CCCC2=O)C=C1 AC500301 [0,0,0,0,1,0|1,1,1]=4 6 B13R2.162 BrC1=CC2=C(CCNC2=O)C=C1 AC050699 [0,0,0,0,1,0|1,1,1]=4 7 B13R2.162 CC1=CC=C2CCCC(=O)C2=C1 AC511948 [0,0,0,0,1,0|2,0,1]=4 8 B13R2.162 ClC1=CC2=C(CCCC2=O)C=C1 AC181374 [0,0,0,0,1,0|1,0,1]=3 9 B13R2.162 NC1=CC2=C(CCCC2=O)C=C1 AC182110 [0,0,0,0,1,0|2,0,1]=4 10 B12R1.17 CNC[C@H](O)C1=CC(O)=CC=C1 HY-B0769 [1,0,1,0,0,0|2,0,0]=4 11 B12R1.17 CNC[C@H](O)C1=CC=CC(O)=C1 HY-B0471 [1,0,1,0,0,0|2,0,0]=4 12 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 AC021496 [0,1,1,0,0,0|2,0,0]=4 13 B14R1.677 CC(Cl)CNCCC1=CC=C(Cl)C=C1 AC021361 [0,1,1,0,0,0|0,0,0]=2 14 B14R1.774 CCCCCCC1=CC=C(O)C=C1O HY-B0986 [0,1,1,0,0,0|2,0,0]=4 15 B14R2.68 CC1=CC=C(C=C1)C2CCCCC2 AC220200 [0,0,1,1,0,0|2,0,0]=4 16 B14R2.68 ClC1=CC=C(C=C1)C2CCNCC2 AC181411 [0,0,1,1,0,0|2,0,0]=4 17 B14R2.68 OC1=CC=C(C=C1)C2CCCCC2 AC180403 [0,0,1,1,0,0|2,0,0]=4 18 B14R2.21 CC1=CC(=CC=C1)C2CCCCC2 AC220201 [0,0,1,1,0,0|2,0,0]=4 19 B14R3.2531 C1C2CNCC1C3=CC=CC=C23 AC020003 [1,0,0,1,0,0|0,0,0]=2 20 B12R2.24 BrC1=CC2=C(CCNC2)C=C1 AC181560 [1,0,0,0,1,0|0,1,0]=3 21 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 AC050461 [1,0,0,0,1,0|0,1,0]=3 22 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 AC511061 [1,0,0,0,1,0|0,1,0]=3 23 B12R2.24 C1CC2=CC(=CC=C2NC1)F LN00182017 [1,0,0,0,1,0|1,1,0]=4 24 B12R2.24 CC1=CC=C2CCNCC2=C1 LN00002081 [1,0,0,0,1,0|1,0,0]=3 25 B12R2.24 CC1=CC=C2CCNCC2=C1 LN00002591 [1,0,0,0,1,0|1,0,0]=3 26 B12R2.24 ClC1=CC=C2CNCCC2=N1 AC182482 [1,0,0,0,1,0|1,0,0]=3 27 B12R2.24 ClC1=CC=C2COCCC2=N1 AC050299 [1,0,0,0,1,0|2,0,0]=4 28 B12R2.24 ClC1=NC2=C(CCCC2)N=C1 AC050386 [1,0,0,0,1,0|2,0,0]=4 29 B12R2.24 NC1=CC2=C(CCCN2)C=C1 AC170059 [1,0,0,0,1,0|2,0,0]=4 30 B12R2.24 OC1=CC2=C(CCCN2)C=C1 AC182222 [1,0,0,0,1,0|2,0,0]=4 31 B12R2.24 OC1=CC2=C(NCCC2)C=C1 AC181118 [1,0,0,0,1,0|2,0,0]=4 32 B12R2.24 OC1=CC=C2CCCCC2=C1 AC512165 [1,0,0,0,1,0|1,0,0]=3 33 B12R2.1081 C1=CC=C2C(=C1)CCCC2N LN00224938 [1,0,0,0,1,0|1,0,0]=3 34 B12R2.1081 CC1CNCC2=C1C=CC=C2 LN00001946 [1,0,0,0,1,0|0,0,0]=2 35 B12R2.1081 CC1CNCC2=CC=CC=C12 LN00245503 [1,0,0,0,1,0|0,0,0]=2 36 B12R2.1081 CC1NCCC2=C1C=CC=C2 AC181112 [1,0,0,0,1,0|0,0,0]=2 37 B12R2.1081 N=C1CCCC2=C1C=CC=C2 AC020396 [1,0,0,0,1,0|1,0,1]=4 38 B12R2.1081 NC1CCOC2=C1C=CC=C2 AC051203 [1,0,0,0,1,0|2,0,0]=4 39 B12R2.1081 N[C@@H]1CCCC2=C1N=CC=C2 AC020125 [1,0,0,0,1,0|2,0,0]=4 40 B12R2.1081 N[C@@H]1CCCC2=C1N=CC=C2 AC170078 [1,0,0,0,1,0|2,0,0]=4 41 B12R2.1081 N[C@H]1CCCC2=C1N=CC=C2 AC020124 [1,0,0,0,1,0|2,0,0]=4 42 B12R2.1081 N[C@H]1CCOC2=C1C=CC=C2 AC182356 [1,0,0,0,1,0|2,0,0]=4 43 B12R2.1081 O=C1CCCC2=C1C=CC=C2 AC220096 [1,0,0,0,1,0|1,0,1]=4 44 B12R2.1081 OC1CCCC2=C1C=CC=C2 AC220110 [1,0,0,0,1,0|1,0,0]=3 45 B12R2.1081 OC1CCCC2=C1N=CC=C2 AC182113 [1,0,0,0,1,0|2,0,0]=4 46 B12R2.132 ClC1=CC2=C(CCC2=O)C=C1 AC181146 [0,0,0,0,2,0|1,0,1]=4