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canSAR1402896
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NAMES
    SMILES
    COc1cc(CCN2C(=O)N[C@@H](CCc3ccccc3)C(C(C)=O)=C2C)cc(OC)c1OC
    InChI
    InChI=1S/C26H32N2O5/c1-17-24(18(2)29)21(12-11-19-9-7-6-8-10-19)27-26(30)28(17)14-13-20-15-22(31-3)25(33-5)23(16-20)32-4/h6-10,15-16,21H,11-14H2,1-5H3,(H,27,30)/t21-/m0/s1
    MOLECULAR FORMULA
    C26H32N2O5
    CROSS REFERENCES
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    canSAR1402896

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 452.23
    AlogP 4.14
    HBond donors 1
    HBond acceptors 7
    Atoms 65
    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 canSAR1402896.