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canSAR2015822
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NAMES
    SMILES
    CNCCCn1ccc2ccc(NC(=N)c3cccs3)cc21.Cl
    InChI
    InChI=1S/C17H20N4S.ClH/c1-19-8-3-9-21-10-7-13-5-6-14(12-15(13)21)20-17(18)16-4-2-11-22-16;/h2,4-7,10-12,19H,3,8-9H2,1H3,(H2,18,20);1H
    MOLECULAR FORMULA
    C17H21ClN4S
    CROSS REFERENCES
    2015822 logo

    canSAR2015822

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 348.12
    AlogP 4.17
    HBond donors 3
    HBond acceptors 4
    Atoms 44
    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 canSAR2015822.