1768880 logo
canSAR1768880
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(C(=O)NCc2ccc3c(c2)OCO3)c([N+](=O)[O-])cc1OC
    InChI
    InChI=1S/C17H16N2O7/c1-23-14-6-11(12(19(21)22)7-15(14)24-2)17(20)18-8-10-3-4-13-16(5-10)26-9-25-13/h3-7H,8-9H2,1-2H3,(H,18,20)
    MOLECULAR FORMULA
    C17H16N2O7
    CROSS REFERENCES
    1768880 logo

    canSAR1768880

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 360.10
    AlogP 2.27
    HBond donors 1
    HBond acceptors 9
    Atoms 42
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1768880.