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canSAR2018298
FEATURES
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NAMES
    SMILES
    C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)[O-])c(O)c2C(=O)O1
    InChI
    InChI=1S/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26)/p-1/t10-,15+/m1/s1
    MOLECULAR FORMULA
    C20H17ClNO6-
    CROSS REFERENCES
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    canSAR2018298

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 402.07
    AlogP 1.24
    HBond donors 2
    HBond acceptors 7
    Atoms 45
    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 canSAR2018298.