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canSAR1687320
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NAMES
    SMILES
    O=C(Cc1c[nH]c2ccccc12)Nc1nc2ccccc2[nH]1
    InChI
    InChI=1S/C17H14N4O/c22-16(9-11-10-18-13-6-2-1-5-12(11)13)21-17-19-14-7-3-4-8-15(14)20-17/h1-8,10,18H,9H2,(H2,19,20,21,22)
    MOLECULAR FORMULA
    C17H14N4O
    CROSS REFERENCES
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    canSAR1687320

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 290.12
    AlogP 3.23
    HBond donors 3
    HBond acceptors 5
    Atoms 36
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1687320.