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canSAR1062429
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NAMES
    SMILES
    COc1ccc(N2CCN(CCC(OC(N)=O)c3ccc(Cl)cc3)CC2)cc1
    InChI
    InChI=1S/C21H26ClN3O3/c1-27-19-8-6-18(7-9-19)25-14-12-24(13-15-25)11-10-20(28-21(23)26)16-2-4-17(22)5-3-16/h2-9,20H,10-15H2,1H3,(H2,23,26)
    MOLECULAR FORMULA
    C21H26ClN3O3
    CROSS REFERENCES
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    canSAR1062429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.17
    AlogP 3.70
    HBond donors 2
    HBond acceptors 6
    Atoms 54
    Contains toxicophore No
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1062429.