1616302 logo
canSAR1616302
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COCCOc1cccc(-c2cn(-c3ccc(C(=O)O)cc3)cc2C#N)c1
    InChI
    InChI=1S/C21H18N2O4/c1-26-9-10-27-19-4-2-3-16(11-19)20-14-23(13-17(20)12-22)18-7-5-15(6-8-18)21(24)25/h2-8,11,13-14H,9-10H2,1H3,(H,24,25)
    MOLECULAR FORMULA
    C21H18N2O4
    CROSS REFERENCES
    1616302 logo

    canSAR1616302

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 362.13
    AlogP 3.74
    HBond donors 1
    HBond acceptors 6
    Atoms 45
    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 canSAR1616302.