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canSAR1769171
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NAMES
    SMILES
    CC(C)Cn1c(CN2CCN(c3cccc(Cl)c3)CC2)nc2c1c(=O)[nH]c(=O)n2C
    InChI
    InChI=1S/C21H27ClN6O2/c1-14(2)12-28-17(23-19-18(28)20(29)24-21(30)25(19)3)13-26-7-9-27(10-8-26)16-6-4-5-15(22)11-16/h4-6,11,14H,7-10,12-13H2,1-3H3,(H,24,29,30)
    MOLECULAR FORMULA
    C21H27ClN6O2
    CROSS REFERENCES
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    canSAR1769171

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 430.19
    AlogP 2.05
    HBond donors 1
    HBond acceptors 8
    Atoms 57
    Contains toxicophore No
    Contains PAINS No
    Commercially available Yes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1769171.