0 B14R1.540 CC(C)C\C=C(\C=O)C1=CC=CC=C1 D70128 [0,0,0,0,0,0|0,0,0]=0 1 B13R1.45 CC(=O)COC(=O)C1=CC=CC=C1 11299 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 30609 [1,0,0,0,0,0|3,0,0]=4 3 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 D78507 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CC=C1 N10791 [1,0,0,0,0,0|1,0,1]=3 5 B13R1.45 CN(C)\C=C\C(=O)C1=CC=NC=C1 31088 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.45 CN(C)\C=C\C(=O)C1=CN=CC=C1 31086 [1,0,0,0,0,0|2,0,1]=4 7 B13R1.45 CN(C)\C=C\C(=O)C1=CN=CC=C1 AC7575 [1,0,0,0,0,0|2,0,1]=4 8 B15R2.39201 CC(=O)N1C=C(C=O)C2=C1C=CC=C2 A10011 [0,0,0,1,0,0|2,0,1]=4 9 B12R1.30 CCCCC(=O)C1=CC=CC=C1 AC8072 [2,0,0,0,0,0|0,0,1]=3 10 B12R1.30 CCCNC(=O)C1=CN=CC=C1 D83800 [2,0,0,0,0,0|2,0,0]=4 11 B12R1.30 CCCOC(=O)C1=CC=CC=C1 D70394 [2,0,0,0,0,0|1,0,0]=3 12 B12R1.30 CNCCC(=O)C1=CC=CC=C1 C74316 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 A11417 [2,0,0,0,0,0|2,0,0]=4 14 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 75520 [2,0,0,0,0,0|2,0,0]=4 15 B12R1.252 CC(C)CNCC1=CC=CC=C1 71268 [2,0,0,0,0,0|1,0,1]=4 16 B14R1.604 CCOC(=O)\C(=C\O)C1=CC=CC=C1 AC7751 [1,1,0,0,0,0|1,0,1]=4 17 B14R1.678 CC(C)COC(=O)C1=CC=C(O)C=C1 42673 [1,1,0,0,0,0|1,0,0]=3 18 B14R1.678 CN(C)CCC(=O)C1=CC=C(Br)C=C1 C16580 [1,1,0,0,0,0|1,0,1]=4 19 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(Cl)C=C1 31174 [1,1,0,0,0,0|1,0,1]=4 20 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(F)C=C1 20573 [1,1,0,0,0,0|1,0,1]=4 21 B14R2.24 O=C1CCCC[C@@H]1C2=CC=CC=C2 C11341 [1,0,0,1,0,0|0,0,2]=4 22 B14R2.29285 CC1(C)CCC(=O)C2=C1C=CC=C2 48447 [1,0,0,1,0,0|0,0,1]=3 23 B14R2.2 CN(C)CC1=CNC2=C1C=CC=C2 60386 [0,0,0,1,1,0|2,0,0]=4 24 B14R2.598 N[C@H]1CC(=O)N(C2=CC=CC=C2)C1 D82814 [0,0,0,1,1,0|2,0,0]=4 25 B16R2.477 CC(C)COC1=CC2=CC=CC=C2C=C1 D97688 [0,0,0,1,0,1|2,0,0]=4 26 B16R2.2888 CC(C)[C@@H]1N=C(C2=CC=CC=C2)OC1=O I59261 [0,1,0,1,0,0|1,0,0]=3 27 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 77874 [1,0,0,0,1,0|1,0,1]=4 28 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 D91120 [1,0,0,0,1,0|0,0,0]=2 29 B12R1.107 CC(C)OC(=O)C1=CC=CC=C1 D88597 [1,0,0,0,1,0|1,0,0]=3 30 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 T70641 [1,0,0,0,1,0|1,0,0]=3 31 B14R1.420 CC(C)=CCOC(=O)C1=CC=CC=C1 D88803 [1,0,0,0,0,1|1,0,1]=4 32 B14R1.420 CN(C)CCOC(=O)C1=CC=CC=C1 F20965 [1,0,0,0,0,1|1,0,1]=4 33 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 D91903 [1,0,0,0,0,1|1,0,0]=3