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canSAR1765987
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NAMES
    SMILES
    O=C(Nc1ccc2[nH]nc(-c3nc4ccccc4[nH]3)c2c1)NC1CC1
    InChI
    InChI=1S/C18H16N6O/c25-18(19-10-5-6-10)20-11-7-8-13-12(9-11)16(24-23-13)17-21-14-3-1-2-4-15(14)22-17/h1-4,7-10H,5-6H2,(H,21,22)(H,23,24)(H2,19,20,25)
    MOLECULAR FORMULA
    C18H16N6O
    CROSS REFERENCES
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    canSAR1765987

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 332.14
    AlogP 3.39
    HBond donors 4
    HBond acceptors 7
    Atoms 41
    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 canSAR1765987.