General Information of the Compound
| Compound ID |
CP0406831
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| Compound Name |
2-(4-(4-fluorophenyl)-2-((4-(methylsulfonyl)phenyl)(phenyl)amino)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C24H19FN2O4S2
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| Molecular Weight |
482.558
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| Canonical SMILES |
CS(=O)(=O)c1ccc(cc1)N(c1nc(c(CC(O)=O)s1)-c1ccc(F)cc1)c1ccccc1
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| InChI |
InChI=1S/C24H19FN2O4S2/c1-33(30,31)20-13-11-19(12-14-20)27(18-5-3-2-4-6-18)24-26-23(21(32-24)15-22(28)29)16-7-9-17(25)10-8-16/h2-14H,15H2,1H3,(H,28,29)
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| InChIKey |
VPQSNFVAMFFBOP-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