General Information of the Compound
| Compound ID |
CP0204242
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| Compound Name |
2-{[(3',4'-Dichloro-biphenyl-4-ylcarbamoyl)-methyl]-sulfamoyl}-benzoic acid
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| Structure |
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| Formula |
C21H16Cl2N2O5S
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| Molecular Weight |
479.341
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| Canonical SMILES |
OC(=O)c1ccccc1S(=O)(=O)NCC(=O)Nc1ccc(cc1)-c1ccc(Cl)c(Cl)c1
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| InChI |
InChI=1S/C21H16Cl2N2O5S/c22-17-10-7-14(11-18(17)23)13-5-8-15(9-6-13)25-20(26)12-24-31(29,30)19-4-2-1-3-16(19)21(27)28/h1-11,24H,12H2,(H,25,26)(H,27,28)
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| InChIKey |
DETCJXKUURQYRY-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound