1135178 logo
canSAR1135178
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=c1[nH]c(=O)n([C@H]2C[C@H](O)[C@@H](CO)O2)cc1-c1ccco1
    InChI
    InChI=1S/C13H14N2O6/c16-6-10-8(17)4-11(21-10)15-5-7(9-2-1-3-20-9)12(18)14-13(15)19/h1-3,5,8,10-11,16-17H,4,6H2,(H,14,18,19)/t8-,10+,11+/m0/s1
    MOLECULAR FORMULA
    C13H14N2O6
    CROSS REFERENCES
    1135178 logo

    canSAR1135178

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 294.09
    AlogP -0.56
    HBond donors 3
    HBond acceptors 8
    Atoms 35
    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 canSAR1135178.