canSAR1809210
FEATURES
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NAMES
    SMILES
    CCCS(=O)(=O)CCc1ccc2c(c1)C(Cc1ccccc1)C(N)CC2
    InChI
    InChI=1S/C22H29NO2S/c1-2-13-26(24,25)14-12-18-8-9-19-10-11-22(23)21(20(19)15-18)16-17-6-4-3-5-7-17/h3-9,15,21-22H,2,10-14,16,23H2,1H3
    MOLECULAR FORMULA
    C22H29NO2S
    CROSS REFERENCES
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    canSAR1809210
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight371.19
    AlogP3.65
    HBond donors2
    HBond acceptors3
    Atoms55
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1809210.