General Information of the Compound
| Compound ID |
CP0296470
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| Compound Name |
2-[4-[butyl-[5-(4-chlorophenyl)-2-(trifluoromethoxy)phenyl]sulfamoyl]-2,3-dimethylphenoxy]propanoic acid
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| Structure |
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| Formula |
C28H29ClF3NO6S
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| Molecular Weight |
600.055
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| Canonical SMILES |
CCCCN(c1cc(ccc1OC(F)(F)F)-c1ccc(Cl)cc1)S(=O)(=O)c1ccc(OC(C)C(O)=O)c(C)c1C
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| InChI |
InChI=1S/C28H29ClF3NO6S/c1-5-6-15-33(40(36,37)26-14-13-24(17(2)18(26)3)38-19(4)27(34)35)23-16-21(20-7-10-22(29)11-8-20)9-12-25(23)39-28(30,31)32/h7-14,16,19H,5-6,15H2,1-4H3,(H,34,35)
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| InChIKey |
OQVWOPQOCVCGSW-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