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canSAR1690635
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NAMES
    SMILES
    O=C(N/N=C/c1ccc2c(c1)OCO2)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1
    InChI
    InChI=1S/C17H13N5O6/c23-17(20-18-6-11-1-3-14-16(5-11)27-10-26-14)15-4-2-13(28-15)9-21-8-12(7-19-21)22(24)25/h1-8H,9-10H2,(H,20,23)/b18-6+
    MOLECULAR FORMULA
    C17H13N5O6
    CROSS REFERENCES
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    canSAR1690635

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 383.09
    AlogP 1.93
    HBond donors 1
    HBond acceptors 11
    Atoms 41
    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 canSAR1690635.