canSAR1931875
FEATURES
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NAMES
    SMILES
    CC1CCN(CCN=C(S)Nc2ccc(Cl)cc2)CC1
    InChI
    InChI=1S/C15H22ClN3S/c1-12-6-9-19(10-7-12)11-8-17-15(20)18-14-4-2-13(16)3-5-14/h2-5,12H,6-11H2,1H3,(H2,17,18,20)
    MOLECULAR FORMULA
    C15H22ClN3S
    CROSS REFERENCES
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    canSAR1931875
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight311.12
    AlogP3.77
    HBond donors1
    HBond acceptors3
    Atoms42
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1931875.