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canSAR790747
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NAMES
    SMILES
    COc1ccc2[nH]c3c(c2c1)CCNC3c1ccccc1
    InChI
    InChI=1S/C18H18N2O/c1-21-13-7-8-16-15(11-13)14-9-10-19-17(18(14)20-16)12-5-3-2-4-6-12/h2-8,11,17,19-20H,9-10H2,1H3
    MOLECULAR FORMULA
    C18H18N2O
    CROSS REFERENCES
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    canSAR790747

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 278.14
    AlogP 3.41
    HBond donors 2
    HBond acceptors 3
    Atoms 39
    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 canSAR790747.