845035 logo
canSAR845035
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCO[C@H]1C(=O)N2C(C(=O)OC(C)(C)C)=C(COC(C)=O)CS(=O)(=O)[C@H]12
    InChI
    InChI=1S/C16H23NO8S/c1-6-23-12-13(19)17-11(15(20)25-16(3,4)5)10(7-24-9(2)18)8-26(21,22)14(12)17/h12,14H,6-8H2,1-5H3/t12-,14+/m0/s1
    MOLECULAR FORMULA
    C16H23NO8S
    CROSS REFERENCES
    845035 logo

    canSAR845035

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 389.11
    AlogP 0.15
    HBond donors 0
    HBond acceptors 9
    Atoms 49
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR845035.