1989291 logo
canSAR1989291
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(C(C[N+](=O)[O-])c2c(-c3ccccc3)cc3ccccn23)cc(OC)c1OC
    InChI
    InChI=1S/C25H24N2O5/c1-30-22-13-18(14-23(31-2)25(22)32-3)21(16-27(28)29)24-20(17-9-5-4-6-10-17)15-19-11-7-8-12-26(19)24/h4-15,21H,16H2,1-3H3
    MOLECULAR FORMULA
    C25H24N2O5
    CROSS REFERENCES
    1989291 logo

    canSAR1989291

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 432.17
    AlogP 5.04
    HBond donors 0
    HBond acceptors 7
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1989291.