1616372 logo
canSAR1616372
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(=C1C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O
    InChI
    InChI=1S/C22H14O6/c1-10(15-17(23)11-6-2-4-8-13(11)19(25)21(15)27)16-18(24)12-7-3-5-9-14(12)20(26)22(16)28/h2-9,23,25,27H,1H3
    MOLECULAR FORMULA
    C22H14O6
    CROSS REFERENCES
    1616372 logo

    canSAR1616372

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 374.08
    AlogP 3.38
    HBond donors 3
    HBond acceptors 6
    Atoms 42
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1616372.