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canSAR1108253
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NAMES
    SMILES
    CCN(Cc1ccccc1)C(=O)Nc1cc(-c2ccc(Cl)cc2)sc1C(=O)OC
    InChI
    InChI=1S/C22H21ClN2O3S/c1-3-25(14-15-7-5-4-6-8-15)22(27)24-18-13-19(29-20(18)21(26)28-2)16-9-11-17(23)12-10-16/h4-13H,3,14H2,1-2H3,(H,24,27)
    MOLECULAR FORMULA
    C22H21ClN2O3S
    CROSS REFERENCES
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    canSAR1108253

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 428.10
    AlogP 5.91
    HBond donors 1
    HBond acceptors 5
    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 canSAR1108253.