General Information of the Compound
| Compound ID |
CP0386849
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| Compound Name |
2-[2-(5-cyano-3-hydroxypyridin-2-yl)-1,3-thiazol-4-yl]-N-(2-phenylethyl)acetamide
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| Structure |
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| Formula |
C19H16N4O2S
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| Molecular Weight |
364.43
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| Canonical SMILES |
Oc1cc(cnc1-c1nc(CC(=O)NCCc2ccccc2)cs1)C#N
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| InChI |
InChI=1S/C19H16N4O2S/c20-10-14-8-16(24)18(22-11-14)19-23-15(12-26-19)9-17(25)21-7-6-13-4-2-1-3-5-13/h1-5,8,11-12,24H,6-7,9H2,(H,21,25)
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| InChIKey |
JFDMCXCLTIPJIW-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