General Information of the Compound
| Compound ID |
CP0558708
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| Compound Name |
N-benzyl-2-[2-(3-hydroxypyridin-2-yl)-1,3-thiazol-4-yl]acetamide
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| Structure |
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| Formula |
C17H15N3O2S
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| Molecular Weight |
325.393
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| Canonical SMILES |
Oc1cccnc1-c1nc(CC(=O)NCc2ccccc2)cs1
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| InChI |
InChI=1S/C17H15N3O2S/c21-14-7-4-8-18-16(14)17-20-13(11-23-17)9-15(22)19-10-12-5-2-1-3-6-12/h1-8,11,21H,9-10H2,(H,19,22)
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| InChIKey |
FUFBIUUUDAUQFY-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