canSAR390158
FEATURES
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NAMES
    SMILES
    COCCOCOc1ccc2c(c1)[C@H](NC(=O)c1ccccc1)[C@@H](O)[C@H](CC(=O)O)N2C(=O)c1ccccc1
    InChI
    InChI=1S/C29H30N2O8/c1-37-14-15-38-18-39-21-12-13-23-22(16-21)26(30-28(35)19-8-4-2-5-9-19)27(34)24(17-25(32)33)31(23)29(36)20-10-6-3-7-11-20/h2-13,16,24,26-27,34H,14-15,17-18H2,1H3,(H,30,35)(H,32,33)/t24-,26-,27-/m0/s1
    MOLECULAR FORMULA
    C29H30N2O8
    CROSS REFERENCES
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    canSAR390158
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight534.20
    AlogP3.02
    HBond donors3
    HBond acceptors10
    Atoms69
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR390158.