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canSAR917185
FEATURES
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NAMES
    SMILES
    CC1CCc2c(sc3ncnc(SCC(=O)O)c23)C1
    InChI
    InChI=1S/C13H14N2O2S2/c1-7-2-3-8-9(4-7)19-13-11(8)12(14-6-15-13)18-5-10(16)17/h6-7H,2-5H2,1H3,(H,16,17)
    MOLECULAR FORMULA
    C13H14N2O2S2
    CROSS REFERENCES
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    canSAR917185

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 294.05
    AlogP 2.99
    HBond donors 1
    HBond acceptors 4
    Atoms 33
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR917185.