canSAR1746298
FEATURES
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NAMES
    SMILES
    Cc1ccc(OCC(=O)Nc2sc3c(c2C#N)CCC3)cc1C
    InChI
    InChI=1S/C18H18N2O2S/c1-11-6-7-13(8-12(11)2)22-10-17(21)20-18-15(9-19)14-4-3-5-16(14)23-18/h6-8H,3-5,10H2,1-2H3,(H,20,21)
    MOLECULAR FORMULA
    C18H18N2O2S
    CROSS REFERENCES
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    canSAR1746298
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight326.11
    AlogP3.74
    HBond donors1
    HBond acceptors4
    Atoms41
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746298.