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canSAR35261
FEATURES
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NAMES
    SMILES
    COC(=O)C(Cc1ccc(OCCN(C)c2nc3ccccc3o2)cc1)SC
    InChI
    InChI=1S/C21H24N2O4S/c1-23(21-22-17-6-4-5-7-18(17)27-21)12-13-26-16-10-8-15(9-11-16)14-19(28-3)20(24)25-2/h4-11,19H,12-14H2,1-3H3
    MOLECULAR FORMULA
    C21H24N2O4S
    CROSS REFERENCES
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    canSAR35261

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.15
    AlogP 3.79
    HBond donors 0
    HBond acceptors 6
    Atoms 52
    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 canSAR35261.