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canSAR195702
FEATURES
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NAMES
    SMILES
    COc1ccc(Cn2nc(-c3ccccc3)c(Cc3cc4c(cc3Cl)OCO4)c2C(=O)O)c(OCC(=O)O)c1
    InChI
    InChI=1S/C28H23ClN2O8/c1-36-19-8-7-17(22(11-19)37-14-25(32)33)13-31-27(28(34)35)20(26(30-31)16-5-3-2-4-6-16)9-18-10-23-24(12-21(18)29)39-15-38-23/h2-8,10-12H,9,13-15H2,1H3,(H,32,33)(H,34,35)
    MOLECULAR FORMULA
    C28H23ClN2O8
    CROSS REFERENCES
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    canSAR195702

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 550.11
    AlogP 4.74
    HBond donors 2
    HBond acceptors 10
    Atoms 62
    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 canSAR195702.