988094 logo
canSAR988094
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(O)/C=C/c1cccc(NS(=O)(=O)c2ccc(C(=O)O)cc2)c1
    InChI
    InChI=1S/C16H13NO6S/c18-15(19)9-4-11-2-1-3-13(10-11)17-24(22,23)14-7-5-12(6-8-14)16(20)21/h1-10,17H,(H,18,19)(H,20,21)/b9-4+
    MOLECULAR FORMULA
    C16H13NO6S
    CROSS REFERENCES
    988094 logo

    canSAR988094

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 347.05
    AlogP 2.28
    HBond donors 3
    HBond acceptors 7
    Atoms 37
    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 canSAR988094.