canSAR2101015
FEATURES
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NAMES
    SMILES
    CCNC(=S)Nc1cc(-n2cnc(CNC)c2)ncn1
    InChI
    InChI=1S/C12H17N7S/c1-3-14-12(20)18-10-4-11(16-7-15-10)19-6-9(5-13-2)17-8-19/h4,6-8,13H,3,5H2,1-2H3,(H2,14,15,16,18,20)
    MOLECULAR FORMULA
    C12H17N7S
    CROSS REFERENCES
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    canSAR2101015
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight291.13
    AlogP0.69
    HBond donors3
    HBond acceptors7
    Atoms37
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR2101015.