canSAR288711
FEATURES
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NAMES
    SMILES
    C[C@@H]1C[C@H]2O[C@@H]2/C=C\C=C\C(=N/OCC(=O)N2CCCCC2)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
    InChI
    InChI=1S/C25H29ClN2O7/c1-15-11-21-20(35-21)8-4-3-7-16(27-33-14-22(31)28-9-5-2-6-10-28)12-17-23(25(32)34-15)18(29)13-19(30)24(17)26/h3-4,7-8,13,15,20-21,29-30H,2,5-6,9-12,14H2,1H3/b7-3+,8-4-,27-16+/t15-,20-,21-/m1/s1
    MOLECULAR FORMULA
    C25H29ClN2O7
    CROSS REFERENCES
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    canSAR288711
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight504.17
    AlogP3.51
    HBond donors2
    HBond acceptors9
    Atoms64
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR288711.