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canSAR845911
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NAMES
    SMILES
    Oc1cccc2c1O[C@H]1CN(CCc3ccccc3)[C@@H]3CCC[C@]21C3
    InChI
    InChI=1S/C22H25NO2/c24-19-10-4-9-18-21(19)25-20-15-23(13-11-16-6-2-1-3-7-16)17-8-5-12-22(18,20)14-17/h1-4,6-7,9-10,17,20,24H,5,8,11-15H2/t17-,20+,22+/m1/s1
    MOLECULAR FORMULA
    C22H25NO2
    CROSS REFERENCES
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    canSAR845911

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 335.19
    AlogP 3.89
    HBond donors 1
    HBond acceptors 3
    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 canSAR845911.