1834944 logo
canSAR1834944
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=NNC(=O)c1ccc(OC2CCCC2)cc1)c1ccc(O)cc1
    InChI
    InChI=1S/C20H22N2O3/c1-14(15-6-10-17(23)11-7-15)21-22-20(24)16-8-12-19(13-9-16)25-18-4-2-3-5-18/h6-13,18,23H,2-5H2,1H3,(H,22,24)
    MOLECULAR FORMULA
    C20H22N2O3
    CROSS REFERENCES
    1834944 logo

    canSAR1834944

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.16
    AlogP 3.87
    HBond donors 2
    HBond acceptors 5
    Atoms 47
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1834944.