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canSAR1121694
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NAMES
    SMILES
    CC(C)C(=O)N1CCC(n2cc(CN3CCc4sccc4C3)nn2)CC1
    InChI
    InChI=1S/C19H27N5OS/c1-14(2)19(25)23-8-3-17(4-9-23)24-13-16(20-21-24)12-22-7-5-18-15(11-22)6-10-26-18/h6,10,13-14,17H,3-5,7-9,11-12H2,1-2H3
    MOLECULAR FORMULA
    C19H27N5OS
    CROSS REFERENCES
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    canSAR1121694

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 373.19
    AlogP 2.72
    HBond donors 0
    HBond acceptors 6
    Atoms 53
    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 canSAR1121694.