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canSAR1721677
FEATURES
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NAMES
    SMILES
    CCOc1ccc(N2C(=O)CC(Sc3nc4ccc(OCC)cc4s3)C2=O)cc1
    InChI
    InChI=1S/C21H20N2O4S2/c1-3-26-14-7-5-13(6-8-14)23-19(24)12-18(20(23)25)29-21-22-16-10-9-15(27-4-2)11-17(16)28-21/h5-11,18H,3-4,12H2,1-2H3
    MOLECULAR FORMULA
    C21H20N2O4S2
    CROSS REFERENCES
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    canSAR1721677

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.09
    AlogP 4.52
    HBond donors 0
    HBond acceptors 6
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1721677.