0 B16R2.477 C1=CC=C2C=C(C=CC2=C1)CCC(=O)O H588147 [0,0,0,0,0,0|3,0,1]=4 1 B16R2.477 C1=CC=C2C=C(C=CC2=C1)OCC(=O)O N114752 [0,0,0,0,0,0|2,0,1]=3 2 B16R2.477 C1=CC=C2C=C(C=CC2=C1)OCC(=O)O N114753 [0,0,0,0,0,0|2,0,1]=3 3 B16R2.477 C1=CC=C2C=C(C=CC2=C1)OCC(=O)[O-] N165365 [0,0,0,0,0,0|2,0,1]=3 4 B16R2.477 CC(C)COC1=CC2=CC=CC=C2C=C1 I157552 [0,0,0,0,0,0|0,0,0]=0 5 B15R2.352 C#CCOC1=CC2=CC=CC=C2C=C1 P160661 [1,0,0,0,0,0|0,0,2]=3 6 B15R2.352 C1=CC=C2C=C(C=CC2=C1)OCCO N140399 [1,0,0,0,0,0|1,0,0]=2 7 B15R2.352 CCCCC1=CC2=CC=CC=C2C=C1 B586422 [1,0,0,0,0,0|1,0,0]=2 8 B15R2.352 CCCOC1=CC2=CC=CC=C2C=C1 P404777 [1,0,0,0,0,0|0,0,0]=1 9 B15R1.5919 CC(C)COC(=O)C=CC1=CC=CC=C1 I101456 [0,0,1,0,0,0|1,0,0]=2 10 B15R2.1668 C1=CC=C2C=C(C=CC2=C1)CC(=O)O N100576 [0,0,0,0,1,0|2,0,1]=4 11 B15R2.1668 CC(=O)OC1=CC2=CC=CC=C2C=C1 N100529 [0,0,0,0,1,0|1,0,1]=3 12 B14R1.423 CC(C)COC(=O)CC1=CC=CC=C1 I107622 [1,0,1,0,0,0|1,0,1]=4 13 B14R1.156 CCCOC(=O)C=CC1=CC=CC=C1 P101493 [1,0,1,0,0,0|1,0,0]=3 14 B14R2.112 C1=CC=C2C(=C1)C=CC(=N2)CCO H178734 [2,0,0,0,0,0|2,0,0]=4 15 B14R2.112 C1=CC=C2C=C(C=CC2=C1)CC#N N134014 [2,0,0,0,0,0|1,0,1]=4 16 B14R2.112 C1=CC=C2C=C(C=CC2=C1)CCN N468914 [2,0,0,0,0,0|1,0,0]=3 17 B14R2.112 C1=CC=C2C=C(C=CC2=C1)CCO N346962 [2,0,0,0,0,0|1,0,0]=3 18 B14R2.112 CCNC1=CC2=CC=CC=C2C=C1 N404388 [2,0,0,0,0,0|1,0,0]=3 19 B14R2.112 CCOC1=CC2=CC=CC=C2C=C1 N101454 [2,0,0,0,0,0|0,0,0]=2 20 B14R2.112 CNCC1=CC2=CC=CC=C2C=C1 N293852 [2,0,0,0,0,0|1,0,0]=3 21 B18R3.110752 CC1=NC2=C(C1(C)C)C3=CC=CC=C3C=C2 T101089 [0,1,0,1,0,0|1,0,1]=4 22 B14R1.160 CC(C)COC(=O)C1=CC=CC=C1O I157509 [0,0,1,0,1,0|2,0,0]=4 23 B14R1.540 CC(C)CC=C(C=O)C1=CC=CC=C1 M107640 [0,0,1,0,1,0|2,0,0]=4 24 B14R1.818 CC(C)OC(=O)C=CC1=CC=CC=C1 I101492 [0,0,1,0,1,0|1,0,0]=3 25 B14R2.67 CCCCC1=CC2=CC=CC=C2O1 B303701 [1,0,0,0,1,0|2,0,0]=4 26 B14R2.2 CN(C)CC1=CNC2=CC=CC=C21 G107687 [0,0,0,0,2,0|2,0,0]=4 27 B14R2.2 CN(C)CC1=CNC2=CC=CC=C21 G107688 [0,0,0,0,2,0|2,0,0]=4 28 B14R2.2 CN(C)CC1=C[NH]C2=C1C=CC=C2 G408192 [0,0,0,0,2,0|2,0,0]=4 29 B14R2.781 CC(=C)C1=CC2=CC=CC=C2C=C1 I157492 [0,0,0,0,2,0|0,0,2]=4 30 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=C1 A151496 [0,0,0,0,2,0|1,0,1]=4 31 B14R2.781 CC(C)C1=CC2=CC=CC=C2C=C1 I157619 [0,0,0,0,2,0|0,0,0]=2 32 B14R2.781 CC(C1=CC2=CC=CC=C2C=C1)N N113471 [0,0,0,0,2,0|1,0,0]=3 33 B14R2.781 CC(C1=CC2=CC=CC=C2C=C1)N S161339 [0,0,0,0,2,0|1,0,0]=3 34 B14R2.781 CC(C1=CC2=CC=CC=C2C=C1)O I169209 [0,0,0,0,2,0|1,0,0]=3 35 B14R2.781 CC(C1=CC2=CC=CC=C2C=C1)O N158973 [0,0,0,0,2,0|1,0,0]=3 36 B14R2.781 CC(C1=CC2=CC=CC=C2C=C1)O R160840 [0,0,0,0,2,0|1,0,0]=3 37 B14R2.781 CN(C)C1=CC2=CC=CC=C2C=C1 N159174 [0,0,0,0,2,0|1,0,0]=3