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canSAR1522406
FEATURES
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NAMES
    SMILES
    COc1ccc(Nc2c(-c3ccco3)nc3ccc(C)cn23)cc1
    InChI
    InChI=1S/C19H17N3O2/c1-13-5-10-17-21-18(16-4-3-11-24-16)19(22(17)12-13)20-14-6-8-15(23-2)9-7-14/h3-12,20H,1-2H3
    MOLECULAR FORMULA
    C19H17N3O2
    CROSS REFERENCES
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    canSAR1522406

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.13
    AlogP 4.65
    HBond donors 1
    HBond acceptors 5
    Atoms 41
    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 canSAR1522406.