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canSAR1407182
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NAMES
    SMILES
    O=C(NN=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1O
    InChI
    InChI=1S/C18H13N3O5/c22-16-7-2-1-6-15(16)18(23)20-19-11-14-8-9-17(26-14)12-4-3-5-13(10-12)21(24)25/h1-11,22H,(H,20,23)
    MOLECULAR FORMULA
    C18H13N3O5
    CROSS REFERENCES
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    canSAR1407182

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 351.09
    AlogP 3.32
    HBond donors 2
    HBond acceptors 8
    Atoms 39
    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 canSAR1407182.