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canSAR1592243
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NAMES
    SMILES
    CC(C)Cn1c(SC(C)C(=O)Nc2ccc3c(c2)OCCO3)nc2ccccc2c1=O
    InChI
    InChI=1S/C23H25N3O4S/c1-14(2)13-26-22(28)17-6-4-5-7-18(17)25-23(26)31-15(3)21(27)24-16-8-9-19-20(12-16)30-11-10-29-19/h4-9,12,14-15H,10-11,13H2,1-3H3,(H,24,27)
    MOLECULAR FORMULA
    C23H25N3O4S
    CROSS REFERENCES
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    canSAR1592243

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 439.16
    AlogP 3.94
    HBond donors 1
    HBond acceptors 7
    Atoms 56
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1592243.