78649 logo
canSAR78649
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)c1ccc(N[C@@H]2OC(CO)[C@H](O)C(O)[C@@H]2O)cc1
    InChI
    InChI=1S/C13H17NO7/c15-5-8-9(16)10(17)11(18)12(21-8)14-7-3-1-6(2-4-7)13(19)20/h1-4,8-12,14-18H,5H2,(H,19,20)/t8?,9-,10?,11-,12+/m0/s1
    MOLECULAR FORMULA
    C13H17NO7
    CROSS REFERENCES
    78649 logo

    canSAR78649

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 299.10
    AlogP -1.40
    HBond donors 6
    HBond acceptors 8
    Atoms 38
    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 canSAR78649.