547357 logo
canSAR547357
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(OC)c2c(C)[n+](-c3ccc4ccccc4c3)c(C)cc2c1
    InChI
    InChI=1S/C23H22NO2/c1-15-11-19-13-21(25-3)14-22(26-4)23(19)16(2)24(15)20-10-9-17-7-5-6-8-18(17)12-20/h5-14H,1-4H3/q+1
    MOLECULAR FORMULA
    C23H22NO2+
    CROSS REFERENCES
    547357 logo

    canSAR547357

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 344.16
    AlogP 4.90
    HBond donors 0
    HBond acceptors 3
    Atoms 48
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR547357.