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canSAR1968993
FEATURES
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NAMES
    SMILES
    CN(C)c1ccc(/C=C(\NC(=O)c2ccccc2)C(=O)NC(CC(=O)O)C(=O)O)cc1
    InChI
    InChI=1S/C22H23N3O6/c1-25(2)16-10-8-14(9-11-16)12-17(23-20(28)15-6-4-3-5-7-15)21(29)24-18(22(30)31)13-19(26)27/h3-12,18H,13H2,1-2H3,(H,23,28)(H,24,29)(H,26,27)(H,30,31)/b17-12-
    MOLECULAR FORMULA
    C22H23N3O6
    CROSS REFERENCES
    1968993 logo

    canSAR1968993

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.16
    AlogP 1.57
    HBond donors 4
    HBond acceptors 9
    Atoms 54
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1968993.