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canSAR654836
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NAMES
    SMILES
    COc1ccc2cc1Oc1ccc(cc1)CCC(=O)CCCC2
    InChI
    InChI=1S/C20H22O3/c1-22-19-13-9-16-4-2-3-5-17(21)10-6-15-7-11-18(12-8-15)23-20(19)14-16/h7-9,11-14H,2-6,10H2,1H3
    MOLECULAR FORMULA
    C20H22O3
    CROSS REFERENCES
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    canSAR654836

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 310.16
    AlogP 4.72
    HBond donors 0
    HBond acceptors 3
    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 canSAR654836.