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canSAR1146072
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NAMES
    SMILES
    CN(C)/C=C/c1nc(C(C)(C)C)cc2c1C(=O)c1ccccc1C2=O
    InChI
    InChI=1S/C21H22N2O2/c1-21(2,3)17-12-15-18(16(22-17)10-11-23(4)5)20(25)14-9-7-6-8-13(14)19(15)24/h6-12H,1-5H3/b11-10+
    MOLECULAR FORMULA
    C21H22N2O2
    CROSS REFERENCES
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    canSAR1146072

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 334.17
    AlogP 3.69
    HBond donors 0
    HBond acceptors 4
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1146072.