canSAR1830221
FEATURES
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NAMES
    SMILES
    CCc1nnc(NC(=O)CSc2nnc(-c3ccco3)o2)s1
    InChI
    InChI=1S/C12H11N5O3S2/c1-2-9-14-16-11(22-9)13-8(18)6-21-12-17-15-10(20-12)7-4-3-5-19-7/h3-5H,2,6H2,1H3,(H,13,16,18)
    MOLECULAR FORMULA
    C12H11N5O3S2
    CROSS REFERENCES
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    canSAR1830221
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight337.03
    AlogP2.47
    HBond donors1
    HBond acceptors8
    Atoms33
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1830221.