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canSAR1129022
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NAMES
    SMILES
    COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2CC(=O)NC2CCCc3ccccc32)cc1OC
    InChI
    InChI=1S/C32H38N2O5/c1-36-28-13-12-21(17-29(28)37-2)16-27-25-19-31(39-4)30(38-3)18-23(25)14-15-34(27)20-32(35)33-26-11-7-9-22-8-5-6-10-24(22)26/h5-6,8,10,12-13,17-19,26-27H,7,9,11,14-16,20H2,1-4H3,(H,33,35)
    MOLECULAR FORMULA
    C32H38N2O5
    CROSS REFERENCES
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    canSAR1129022

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 530.28
    AlogP 5.06
    HBond donors 1
    HBond acceptors 7
    Atoms 77
    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 canSAR1129022.