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canSAR113140
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NAMES
    SMILES
    CCOC(Cc1ccc2oc(Cc3nc(-c4cccs4)oc3C)cc2c1)C(=O)O
    InChI
    InChI=1S/C22H21NO5S/c1-3-26-19(22(24)25)10-14-6-7-18-15(9-14)11-16(28-18)12-17-13(2)27-21(23-17)20-5-4-8-29-20/h4-9,11,19H,3,10,12H2,1-2H3,(H,24,25)
    MOLECULAR FORMULA
    C22H21NO5S
    CROSS REFERENCES
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    canSAR113140

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 411.11
    AlogP 5.08
    HBond donors 1
    HBond acceptors 6
    Atoms 50
    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 canSAR113140.