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canSAR1765396
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NAMES
    SMILES
    COc1cc(/C=C2/SC(=S)N(C)C2=O)ccc1OC(=O)c1ccco1
    InChI
    InChI=1S/C17H13NO5S2/c1-18-15(19)14(25-17(18)24)9-10-5-6-11(13(8-10)21-2)23-16(20)12-4-3-7-22-12/h3-9H,1-2H3/b14-9+
    MOLECULAR FORMULA
    C17H13NO5S2
    CROSS REFERENCES
    1765396 logo

    canSAR1765396

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 375.02
    AlogP 3.34
    HBond donors 0
    HBond acceptors 6
    Atoms 38
    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 canSAR1765396.