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canSAR228213
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NAMES
    SMILES
    COc1cccc(OC)c1[C@H]1CC[C@@H](N2CCN(c3ccccn3)CC2)CC1
    InChI
    InChI=1S/C23H31N3O2/c1-27-20-6-5-7-21(28-2)23(20)18-9-11-19(12-10-18)25-14-16-26(17-15-25)22-8-3-4-13-24-22/h3-8,13,18-19H,9-12,14-17H2,1-2H3/t18-,19+
    MOLECULAR FORMULA
    C23H31N3O2
    CROSS REFERENCES
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    canSAR228213

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 381.24
    AlogP 3.95
    HBond donors 0
    HBond acceptors 5
    Atoms 59
    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 canSAR228213.