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canSAR562016
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NAMES
    SMILES
    C[n+]1c(-c2ccc(/C=N/Nc3cc(N)[nH]n3)cc2)cn2ccccc21
    InChI
    InChI=1S/C18H18N7/c1-24-15(12-25-9-3-2-4-18(24)25)14-7-5-13(6-8-14)11-20-22-17-10-16(19)21-23-17/h2-12H,1H3,(H4,19,21,22,23)/q+1/b20-11+
    MOLECULAR FORMULA
    C18H18N7+
    CROSS REFERENCES
    562016 logo

    canSAR562016

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 332.16
    AlogP 2.18
    HBond donors 4
    HBond acceptors 7
    Atoms 43
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR562016.