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canSAR1154796
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NAMES
    SMILES
    COc1ccc(C[C@@H]2CCC[C@H](Cc3ccc(OC)cc3)N2C[C@@H](O)CO)cc1
    InChI
    InChI=1S/C24H33NO4/c1-28-23-10-6-18(7-11-23)14-20-4-3-5-21(25(20)16-22(27)17-26)15-19-8-12-24(29-2)13-9-19/h6-13,20-22,26-27H,3-5,14-17H2,1-2H3/t20-,21+,22-/m1/s1
    MOLECULAR FORMULA
    C24H33NO4
    CROSS REFERENCES
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    canSAR1154796

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 399.24
    AlogP 3.07
    HBond donors 2
    HBond acceptors 5
    Atoms 62
    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 canSAR1154796.