canSAR1834103
FEATURES
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NAMES
    SMILES
    COc1ccc(-n2nnnc2SCC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)cc1
    InChI
    InChI=1S/C19H18N6O5S/c1-28-14-5-3-13(4-6-14)25-19(22-23-24-25)31-11-17(26)21-18(27)20-12-2-7-15-16(10-12)30-9-8-29-15/h2-7,10H,8-9,11H2,1H3,(H2,20,21,26,27)
    MOLECULAR FORMULA
    C19H18N6O5S
    CROSS REFERENCES
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    canSAR1834103
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight442.11
    AlogP1.88
    HBond donors2
    HBond acceptors11
    Atoms49
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1834103.