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canSAR785287
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NAMES
    SMILES
    CC(C)c1csc(-c2nn(CN3CCN(C)CC3)c(=S)n2/N=C/c2ccccc2Cl)n1
    InChI
    InChI=1S/C21H26ClN7S2/c1-15(2)18-13-31-20(24-18)19-25-28(14-27-10-8-26(3)9-11-27)21(30)29(19)23-12-16-6-4-5-7-17(16)22/h4-7,12-13,15H,8-11,14H2,1-3H3/b23-12+
    MOLECULAR FORMULA
    C21H26ClN7S2
    CROSS REFERENCES
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    canSAR785287

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 475.14
    AlogP 4.40
    HBond donors 0
    HBond acceptors 7
    Atoms 57
    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 canSAR785287.