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canSAR2207558
FEATURES
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NAMES
    SMILES
    CCOC(=O)[C@H](CC)N1C(=O)[C@@H](CC(=O)O)C[C@H](c2cccc(Cl)c2)C1c1ccc(Cl)cc1
    InChI
    InChI=1S/C25H27Cl2NO5/c1-3-21(25(32)33-4-2)28-23(15-8-10-18(26)11-9-15)20(16-6-5-7-19(27)12-16)13-17(24(28)31)14-22(29)30/h5-12,17,20-21,23H,3-4,13-14H2,1-2H3,(H,29,30)/t17-,20-,21+,23?/m1/s1
    MOLECULAR FORMULA
    C25H27Cl2NO5
    CROSS REFERENCES
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    canSAR2207558

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 491.13
    AlogP 5.48
    HBond donors 1
    HBond acceptors 6
    Atoms 60
    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 canSAR2207558.