canSAR1846469
FEATURES
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NAMES
    SMILES
    C=CCN=c1scc(-c2ccco2)n1N=Cc1ccc(O)c(O)c1O
    InChI
    InChI=1S/C17H15N3O4S/c1-2-7-18-17-20(12(10-25-17)14-4-3-8-24-14)19-9-11-5-6-13(21)16(23)15(11)22/h2-6,8-10,21-23H,1,7H2
    MOLECULAR FORMULA
    C17H15N3O4S
    CROSS REFERENCES
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    canSAR1846469
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight357.08
    AlogP2.90
    HBond donors3
    HBond acceptors7
    Atoms40
    Contains toxicophoreYes
    Contains PAINSYes
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846469.