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canSAR500979
FEATURES
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NAMES
    SMILES
    CC(C)(C)OC(=O)n1c(-c2ccc(CN)cc2)cc2ccccc21
    InChI
    InChI=1S/C20H22N2O2/c1-20(2,3)24-19(23)22-17-7-5-4-6-16(17)12-18(22)15-10-8-14(13-21)9-11-15/h4-12H,13,21H2,1-3H3
    MOLECULAR FORMULA
    C20H22N2O2
    CROSS REFERENCES
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    canSAR500979

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 322.17
    AlogP 4.55
    HBond donors 2
    HBond acceptors 4
    Atoms 46
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR500979.