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canSAR1863467
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NAMES
    SMILES
    O=C(CCc1nnc2ccc(NCc3ccco3)nn12)Nc1ccccn1
    InChI
    InChI=1S/C18H17N7O2/c26-18(21-14-5-1-2-10-19-14)9-8-17-23-22-16-7-6-15(24-25(16)17)20-12-13-4-3-11-27-13/h1-7,10-11H,8-9,12H2,(H,20,24)(H,19,21,26)
    MOLECULAR FORMULA
    C18H17N7O2
    CROSS REFERENCES
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    canSAR1863467

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 363.14
    AlogP 2.30
    HBond donors 2
    HBond acceptors 9
    Atoms 44
    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 canSAR1863467.