canSAR1746834
FEATURES
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NAMES
    SMILES
    Cc1ccc(C)c(OCC(=O)Nc2sc3c(c2C#N)CCCC3)c1C
    InChI
    InChI=1S/C20H22N2O2S/c1-12-8-9-13(2)19(14(12)3)24-11-18(23)22-20-16(10-21)15-6-4-5-7-17(15)25-20/h8-9H,4-7,11H2,1-3H3,(H,22,23)
    MOLECULAR FORMULA
    C20H22N2O2S
    CROSS REFERENCES
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    canSAR1746834
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight354.14
    AlogP4.44
    HBond donors1
    HBond acceptors4
    Atoms47
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1746834.