2052496 logo
canSAR2052496
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc(/C=C2\Cc3cc(OC)c(OC)c(OC)c3C2=O)cc1[N+](=O)[O-]
    InChI
    InChI=1S/C20H19NO7/c1-25-15-6-5-11(8-14(15)21(23)24)7-13-9-12-10-16(26-2)19(27-3)20(28-4)17(12)18(13)22/h5-8,10H,9H2,1-4H3/b13-7+
    MOLECULAR FORMULA
    C20H19NO7
    CROSS REFERENCES
    2052496 logo

    canSAR2052496

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 385.12
    AlogP 3.45
    HBond donors 0
    HBond acceptors 8
    Atoms 47
    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 canSAR2052496.