General Information of the Compound
| Compound ID |
CP0430747
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| Compound Name |
2-(4-(4-fluorophenyl)-2-(2-methoxyphenylamino)thiazol-5-yl)acetic acid
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| Structure |
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| Formula |
C18H15FN2O3S
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| Molecular Weight |
358.394
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| Canonical SMILES |
COc1ccccc1Nc1nc(c(CC(O)=O)s1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C18H15FN2O3S/c1-24-14-5-3-2-4-13(14)20-18-21-17(15(25-18)10-16(22)23)11-6-8-12(19)9-7-11/h2-9H,10H2,1H3,(H,20,21)(H,22,23)
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| InChIKey |
DOEFHOXIFDEZCF-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