92064 logo
canSAR92064
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    NCCN1C(=O)S/C(=C\c2ccc3c(c2)OCCO3)C1=O
    InChI
    InChI=1S/C14H14N2O4S/c15-3-4-16-13(17)12(21-14(16)18)8-9-1-2-10-11(7-9)20-6-5-19-10/h1-2,7-8H,3-6,15H2/b12-8-
    MOLECULAR FORMULA
    C14H14N2O4S
    CROSS REFERENCES
    92064 logo

    canSAR92064

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 306.07
    AlogP 1.45
    HBond donors 2
    HBond acceptors 6
    Atoms 35
    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 canSAR92064.