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canSAR1442338
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NAMES
    SMILES
    O=C1N=C(S)SC1=Cc1ccc(-c2ccccc2C(=O)O)o1
    InChI
    InChI=1S/C15H9NO4S2/c17-13-12(22-15(21)16-13)7-8-5-6-11(20-8)9-3-1-2-4-10(9)14(18)19/h1-7H,(H,18,19)(H,16,17,21)
    MOLECULAR FORMULA
    C15H9NO4S2
    CROSS REFERENCES
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    canSAR1442338

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 331.00
    AlogP 3.54
    HBond donors 1
    HBond acceptors 5
    Atoms 31
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1442338.