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canSAR49976
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NAMES
    SMILES
    CCCCCC/N=C(\NC)Nc1nc(-c2c[nH]c(C)c2)cs1
    InChI
    InChI=1S/C16H25N5S/c1-4-5-6-7-8-18-15(17-3)21-16-20-14(11-22-16)13-9-12(2)19-10-13/h9-11,19H,4-8H2,1-3H3,(H2,17,18,20,21)
    MOLECULAR FORMULA
    C16H25N5S
    CROSS REFERENCES
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    canSAR49976

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.18
    AlogP 4.01
    HBond donors 3
    HBond acceptors 5
    Atoms 47
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR49976.