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canSAR1721896
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NAMES
    SMILES
    CC(NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NCCN(C)C.Cl
    InChI
    InChI=1S/C18H31N3O2.ClH/c1-12(16(22)19-4-5-21(2)3)20-17(23)18-9-13-6-14(10-18)8-15(7-13)11-18;/h12-15H,4-11H2,1-3H3,(H,19,22)(H,20,23);1H
    MOLECULAR FORMULA
    C18H32ClN3O2
    CROSS REFERENCES
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    canSAR1721896

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 357.22
    AlogP 1.81
    HBond donors 2
    HBond acceptors 5
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1721896.