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canSAR1523881
FEATURES
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NAMES
    SMILES
    O=C(CSc1ccccc1C(=O)O)c1ccc([N+](=O)[O-])cc1
    InChI
    InChI=1S/C15H11NO5S/c17-13(10-5-7-11(8-6-10)16(20)21)9-22-14-4-2-1-3-12(14)15(18)19/h1-8H,9H2,(H,18,19)
    MOLECULAR FORMULA
    C15H11NO5S
    CROSS REFERENCES
    1523881 logo

    canSAR1523881

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 317.04
    AlogP 3.27
    HBond donors 1
    HBond acceptors 6
    Atoms 33
    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 canSAR1523881.