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canSAR1714842
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NAMES
    SMILES
    CC[C@]12CCCN3CC[C@]4(C(=Nc5ccccc54)C(C(=O)OC)C1)[C@@H]32
    InChI
    InChI=1S/C21H26N2O2/c1-3-20-9-6-11-23-12-10-21(19(20)23)15-7-4-5-8-16(15)22-17(21)14(13-20)18(24)25-2/h4-5,7-8,14,19H,3,6,9-13H2,1-2H3/t14?,19-,20-,21-/m0/s1
    MOLECULAR FORMULA
    C21H26N2O2
    CROSS REFERENCES
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    canSAR1714842

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 338.20
    AlogP 3.47
    HBond donors 0
    HBond acceptors 4
    Atoms 51
    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 canSAR1714842.