General Information of the Compound
| Compound ID |
CP0376342
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| Compound Name |
5-(4-Methanesulfonyl-phenyl)-6-(3-methoxy-phenyl)-thiazolo[3,2-b][1,2,4]triazole
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| Structure |
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| Formula |
C18H15N3O3S2
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| Molecular Weight |
385.47
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| Canonical SMILES |
COc1cccc(c1)-c1c(sc2ncnn12)-c1ccc(cc1)S(C)(=O)=O
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| InChI |
InChI=1S/C18H15N3O3S2/c1-24-14-5-3-4-13(10-14)16-17(25-18-19-11-20-21(16)18)12-6-8-15(9-7-12)26(2,22)23/h3-11H,1-2H3
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| InChIKey |
FGBHTDXMLNCJCI-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
Protein ID: PT00940, Prostaglandin G/H synthase 1
Protein ID: PT00901, Prostaglandin G/H synthase 2