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canSAR466839
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NAMES
    SMILES
    CC1=C(/C=C/C#Cc2ccc(C(=O)O)cc2)C(C)(C)CCC1
    InChI
    InChI=1S/C20H22O2/c1-15-7-6-14-20(2,3)18(15)9-5-4-8-16-10-12-17(13-11-16)19(21)22/h5,9-13H,6-7,14H2,1-3H3,(H,21,22)/b9-5+
    MOLECULAR FORMULA
    C20H22O2
    CROSS REFERENCES
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    canSAR466839

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 294.16
    AlogP 4.82
    HBond donors 1
    HBond acceptors 2
    Atoms 44
    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 canSAR466839.