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canSAR668438
FEATURES
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NAMES
    SMILES
    O=C(Nc1cscc1-c1nc(O)c(O)c(C(=O)O)n1)OCc1ccccc1
    InChI
    InChI=1S/C17H13N3O6S/c21-13-12(16(23)24)19-14(20-15(13)22)10-7-27-8-11(10)18-17(25)26-6-9-4-2-1-3-5-9/h1-5,7-8,21H,6H2,(H,18,25)(H,23,24)(H,19,20,22)
    MOLECULAR FORMULA
    C17H13N3O6S
    CROSS REFERENCES
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    canSAR668438

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 387.05
    AlogP 3.06
    HBond donors 4
    HBond acceptors 9
    Atoms 40
    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 canSAR668438.