canSAR1417457
FEATURES
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NAMES
    SMILES
    CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)OCC(=O)Nc2cccnc2Cl)cc1
    InChI
    InChI=1S/C20H22ClN3O5S/c1-3-24(4-2)30(27,28)16-10-7-15(8-11-16)9-12-19(26)29-14-18(25)23-17-6-5-13-22-20(17)21/h5-13H,3-4,14H2,1-2H3,(H,23,25)/b12-9+
    MOLECULAR FORMULA
    C20H22ClN3O5S
    CROSS REFERENCES
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    canSAR1417457
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight451.10
    AlogP2.96
    HBond donors1
    HBond acceptors8
    Atoms52
    Contains toxicophoreYes
    Contains PAINSNo
    Commercially availableYes
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417457.