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canSAR344223
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NAMES
    SMILES
    Cc1c(C)c2c(c(C)c1OC(=O)CCN)CC(CCn1ccc(=O)c(O)c1C)O2
    InChI
    InChI=1S/C22H28N2O5/c1-12-13(2)22-17(14(3)21(12)29-19(26)5-8-23)11-16(28-22)6-9-24-10-7-18(25)20(27)15(24)4/h7,10,16,27H,5-6,8-9,11,23H2,1-4H3
    MOLECULAR FORMULA
    C22H28N2O5
    CROSS REFERENCES
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    canSAR344223

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 400.20
    AlogP 2.44
    HBond donors 3
    HBond acceptors 7
    Atoms 57
    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 canSAR344223.