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canSAR1595882
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NAMES
    SMILES
    CC(=Cc1ccccc1)C=C1SC(=S)N(CC(=O)O)C1=O
    InChI
    InChI=1S/C15H13NO3S2/c1-10(7-11-5-3-2-4-6-11)8-12-14(19)16(9-13(17)18)15(20)21-12/h2-8H,9H2,1H3,(H,17,18)
    MOLECULAR FORMULA
    C15H13NO3S2
    CROSS REFERENCES
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    canSAR1595882

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.03
    AlogP 2.92
    HBond donors 1
    HBond acceptors 4
    Atoms 34
    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 canSAR1595882.