2002034 logo
canSAR2002034
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)c1ccccc1NC(=O)Cc1c(C(=O)O)n(C)c2ccccc12
    InChI
    InChI=1S/C21H20N2O5/c1-3-28-21(27)14-9-4-6-10-16(14)22-18(24)12-15-13-8-5-7-11-17(13)23(2)19(15)20(25)26/h4-11H,3,12H2,1-2H3,(H,22,24)(H,25,26)
    MOLECULAR FORMULA
    C21H20N2O5
    CROSS REFERENCES
    2002034 logo

    canSAR2002034

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 380.14
    AlogP 3.23
    HBond donors 2
    HBond acceptors 7
    Atoms 48
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2002034.