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canSAR548209
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NAMES
    SMILES
    COc1cccc(-c2ccc3ccnc(N)c3c2)c1
    InChI
    InChI=1S/C16H14N2O/c1-19-14-4-2-3-12(9-14)13-6-5-11-7-8-18-16(17)15(11)10-13/h2-10H,1H3,(H2,17,18)
    MOLECULAR FORMULA
    C16H14N2O
    CROSS REFERENCES
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    canSAR548209

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 250.11
    AlogP 3.49
    HBond donors 2
    HBond acceptors 3
    Atoms 33
    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 canSAR548209.