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canSAR84180
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NAMES
    SMILES
    O=C(OCC#CCN1CC2CC2C1)C(O)(c1ccccc1)c1ccccc1
    InChI
    InChI=1S/C23H23NO3/c25-22(27-14-8-7-13-24-16-18-15-19(18)17-24)23(26,20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,18-19,26H,13-17H2
    MOLECULAR FORMULA
    C23H23NO3
    CROSS REFERENCES
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    canSAR84180

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 361.17
    AlogP 2.42
    HBond donors 1
    HBond acceptors 4
    Atoms 50
    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 canSAR84180.