2089707 logo
canSAR2089707
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)[C@H]1CNCC[C@H]1CCC#Cc1ccccc1-c1ccccc1
    InChI
    InChI=1S/C22H23NO2/c24-22(25)21-16-23-15-14-19(21)12-5-4-10-18-11-6-7-13-20(18)17-8-2-1-3-9-17/h1-3,6-9,11,13,19,21,23H,5,12,14-16H2,(H,24,25)/t19-,21+/m1/s1
    MOLECULAR FORMULA
    C22H23NO2
    CROSS REFERENCES
    2089707 logo

    canSAR2089707

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 333.17
    AlogP 3.80
    HBond donors 2
    HBond acceptors 3
    Atoms 48
    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 canSAR2089707.