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canSAR1720266
FEATURES
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NAMES
    SMILES
    O=C(CCN1C(=O)/C(=C/c2ccc(Cl)cc2)SC1=S)NC1C=CS(=O)(=O)C1
    InChI
    InChI=1S/C17H15ClN2O4S3/c18-12-3-1-11(2-4-12)9-14-16(22)20(17(25)26-14)7-5-15(21)19-13-6-8-27(23,24)10-13/h1-4,6,8-9,13H,5,7,10H2,(H,19,21)/b14-9-
    MOLECULAR FORMULA
    C17H15ClN2O4S3
    CROSS REFERENCES
    1720266 logo

    canSAR1720266

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 441.99
    AlogP 2.36
    HBond donors 1
    HBond acceptors 6
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1720266.