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canSAR1533247
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)Cn2c(CCC(=O)O)ccc2-c2ccccc2)cc1
    InChI
    InChI=1S/C22H22N2O4/c1-28-19-11-7-17(8-12-19)23-21(25)15-24-18(10-14-22(26)27)9-13-20(24)16-5-3-2-4-6-16/h2-9,11-13H,10,14-15H2,1H3,(H,23,25)(H,26,27)
    MOLECULAR FORMULA
    C22H22N2O4
    CROSS REFERENCES
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    canSAR1533247

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 378.16
    AlogP 3.82
    HBond donors 2
    HBond acceptors 6
    Atoms 50
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1533247.