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canSAR2016117
FEATURES
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NAMES
    SMILES
    CC(C)NC(=O)c1noc(-c2cc(C(C)C)c(O)cc2O)c1C#Cc1ccccc1
    InChI
    InChI=1S/C24H24N2O4/c1-14(2)18-12-19(21(28)13-20(18)27)23-17(11-10-16-8-6-5-7-9-16)22(26-30-23)24(29)25-15(3)4/h5-9,12-15,27-28H,1-4H3,(H,25,29)
    MOLECULAR FORMULA
    C24H24N2O4
    CROSS REFERENCES
    2016117 logo

    canSAR2016117

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 404.17
    AlogP 4.41
    HBond donors 3
    HBond acceptors 6
    Atoms 54
    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 canSAR2016117.