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canSAR1018261
FEATURES
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NAMES
    SMILES
    COc1cccc([C@H]2O[C@H](CC(=O)NCC(=O)O)c3cccn3-c3ccc(Cl)cc32)c1OC
    InChI
    InChI=1S/C24H23ClN2O6/c1-31-19-7-3-5-15(24(19)32-2)23-16-11-14(25)8-9-17(16)27-10-4-6-18(27)20(33-23)12-21(28)26-13-22(29)30/h3-11,20,23H,12-13H2,1-2H3,(H,26,28)(H,29,30)/t20-,23-/m1/s1
    MOLECULAR FORMULA
    C24H23ClN2O6
    CROSS REFERENCES
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    canSAR1018261

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 470.12
    AlogP 3.90
    HBond donors 2
    HBond acceptors 8
    Atoms 56
    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 canSAR1018261.