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canSAR186038
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NAMES
    SMILES
    CC(C)c1ccccc1Sc1c(O)cc(-c2cccc(O)c2)oc1=O
    InChI
    InChI=1S/C20H18O4S/c1-12(2)15-8-3-4-9-18(15)25-19-16(22)11-17(24-20(19)23)13-6-5-7-14(21)10-13/h3-12,21-22H,1-2H3
    MOLECULAR FORMULA
    C20H18O4S
    CROSS REFERENCES
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    canSAR186038

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 354.09
    AlogP 4.99
    HBond donors 2
    HBond acceptors 4
    Atoms 43
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR186038.