canSAR946093
FEATURES
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NAMES
    SMILES
    Cc1cc(Nc2cc(C)c(C#N)c(SCCCCCCN)n2)n[nH]1
    InChI
    InChI=1S/C17H24N6S/c1-12-9-15(20-16-10-13(2)22-23-16)21-17(14(12)11-19)24-8-6-4-3-5-7-18/h9-10H,3-8,18H2,1-2H3,(H2,20,21,22,23)
    MOLECULAR FORMULA
    C17H24N6S
    CROSS REFERENCES
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    canSAR946093
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight344.18
    AlogP3.65
    HBond donors4
    HBond acceptors6
    Atoms48
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR946093.