986124 logo
canSAR986124
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1ccc2c(c1)O/C(=C\c1ccc(O)c(O)c1)C2=O
    InChI
    InChI=1S/C16H12O5/c1-20-10-3-4-11-14(8-10)21-15(16(11)19)7-9-2-5-12(17)13(18)6-9/h2-8,17-18H,1H3/b15-7-
    MOLECULAR FORMULA
    C16H12O5
    CROSS REFERENCES
    986124 logo

    canSAR986124

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 284.07
    AlogP 2.72
    HBond donors 2
    HBond acceptors 5
    Atoms 33
    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 canSAR986124.