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canSAR1971335
FEATURES
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NAMES
    SMILES
    Cc1nnc(N2C(=O)C(O)=C(C(=O)c3ccco3)C2c2cccc([N+](=O)[O-])c2)s1
    InChI
    InChI=1S/C18H12N4O6S/c1-9-19-20-18(29-9)21-14(10-4-2-5-11(8-10)22(26)27)13(16(24)17(21)25)15(23)12-6-3-7-28-12/h2-8,14,24H,1H3
    MOLECULAR FORMULA
    C18H12N4O6S
    CROSS REFERENCES
    1971335 logo

    canSAR1971335

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 412.05
    AlogP 3.13
    HBond donors 1
    HBond acceptors 10
    Atoms 41
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1971335.