canSAR1631920
FEATURES
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NAMES
    SMILES
    COc1ccc(Nc2ccc3cc(S(=O)(=O)N4CCCC4)ccc3n2)cc1OC
    InChI
    InChI=1S/C21H23N3O4S/c1-27-19-9-6-16(14-20(19)28-2)22-21-10-5-15-13-17(7-8-18(15)23-21)29(25,26)24-11-3-4-12-24/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,22,23)
    MOLECULAR FORMULA
    C21H23N3O4S
    CROSS REFERENCES
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    canSAR1631920
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight413.14
    AlogP3.78
    HBond donors1
    HBond acceptors7
    Atoms52
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1631920.