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canSAR83445
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NAMES
    SMILES
    C=CCOCn1c(Cc2ccccc2)c(C(C)C)c(=O)[nH]c1=O
    InChI
    InChI=1S/C18H22N2O3/c1-4-10-23-12-20-15(11-14-8-6-5-7-9-14)16(13(2)3)17(21)19-18(20)22/h4-9,13H,1,10-12H2,2-3H3,(H,19,21,22)
    MOLECULAR FORMULA
    C18H22N2O3
    CROSS REFERENCES
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    canSAR83445

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 314.16
    AlogP 2.41
    HBond donors 1
    HBond acceptors 5
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR83445.