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canSAR848073
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NAMES
    SMILES
    CCCN1C[C@]2(CCN3CCc4cc(OC)c(OC)cc4[C@@H]3C2)OC1=O
    InChI
    InChI=1S/C20H28N2O4/c1-4-7-22-13-20(26-19(22)23)6-9-21-8-5-14-10-17(24-2)18(25-3)11-15(14)16(21)12-20/h10-11,16H,4-9,12-13H2,1-3H3/t16-,20+/m0/s1
    MOLECULAR FORMULA
    C20H28N2O4
    CROSS REFERENCES
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    canSAR848073

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.20
    AlogP 3.00
    HBond donors 0
    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 canSAR848073.