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canSAR462713
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NAMES
    SMILES
    O=C(O)COc1ccc(Nc2ncc([N+](=O)[O-])c(Nc3ccccc3)n2)cc1
    InChI
    InChI=1S/C18H15N5O5/c24-16(25)11-28-14-8-6-13(7-9-14)21-18-19-10-15(23(26)27)17(22-18)20-12-4-2-1-3-5-12/h1-10H,11H2,(H,24,25)(H2,19,20,21,22)
    MOLECULAR FORMULA
    C18H15N5O5
    CROSS REFERENCES
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    canSAR462713

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.11
    AlogP 3.34
    HBond donors 3
    HBond acceptors 10
    Atoms 43
    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 canSAR462713.