canSAR1832670
FEATURES
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NAMES
    SMILES
    Cc1ccc(NC(=O)CSc2nnc(-c3cnccn3)n2C)cc1C
    InChI
    InChI=1S/C17H18N6OS/c1-11-4-5-13(8-12(11)2)20-15(24)10-25-17-22-21-16(23(17)3)14-9-18-6-7-19-14/h4-9H,10H2,1-3H3,(H,20,24)
    MOLECULAR FORMULA
    C17H18N6OS
    CROSS REFERENCES
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    canSAR1832670
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight354.13
    AlogP2.62
    HBond donors1
    HBond acceptors7
    Atoms43
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1832670.