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canSAR833105
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NAMES
    SMILES
    C=C(c1ccc2ccccc2c1)C1CCC2(CC1)COC(Nc1ccc(C)cc1)OO2
    InChI
    InChI=1S/C27H29NO3/c1-19-7-11-25(12-8-19)28-26-29-18-27(31-30-26)15-13-21(14-16-27)20(2)23-10-9-22-5-3-4-6-24(22)17-23/h3-12,17,21,26,28H,2,13-16,18H2,1H3
    MOLECULAR FORMULA
    C27H29NO3
    CROSS REFERENCES
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    canSAR833105

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.21
    AlogP 6.46
    HBond donors 1
    HBond acceptors 4
    Atoms 60
    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 canSAR833105.