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canSAR56556
FEATURES
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NAMES
    SMILES
    CCOc1cc(F)c(CC(CC)C(=O)O)cc1CNC(=O)c1ccc(C23CC4CC(CC(C4)C2)C3)cc1F
    InChI
    InChI=1S/C31H37F2NO4/c1-3-21(30(36)37)10-22-11-23(28(38-4-2)13-26(22)32)17-34-29(35)25-6-5-24(12-27(25)33)31-14-18-7-19(15-31)9-20(8-18)16-31/h5-6,11-13,18-21H,3-4,7-10,14-17H2,1-2H3,(H,34,35)(H,36,37)
    MOLECULAR FORMULA
    C31H37F2NO4
    CROSS REFERENCES
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    canSAR56556

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.27
    AlogP 6.41
    HBond donors 2
    HBond acceptors 5
    Atoms 75
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR56556.