canSAR1932229
FEATURES
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NAMES
    SMILES
    Cc1ccc(C(=O)NCC(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)cc1C
    InChI
    InChI=1S/C21H20N2O6/c1-12-3-4-15(7-13(12)2)21(27)22-9-20(26)29-10-17(24)14-5-6-18-16(8-14)23-19(25)11-28-18/h3-8H,9-11H2,1-2H3,(H,22,27)(H,23,25)
    MOLECULAR FORMULA
    C21H20N2O6
    CROSS REFERENCES
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    canSAR1932229
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight396.13
    AlogP1.79
    HBond donors2
    HBond acceptors8
    Atoms49
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1932229.