General Information of the Compound
| Compound ID |
CP0411086
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| Compound Name |
1-(1-phenyl-1H-tetrazol-5-ylthio)propan-2-one
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| Synonyms |
1-(1-phenyl-1H-tetrazol-5-ylthio)propan-2-one
CHEMBL1082938
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| Structure |
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| Formula |
C11H11N3OS
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| Molecular Weight |
233.296
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| Canonical SMILES |
CC(=O)CSc1cnnn1-c1ccccc1
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| InChI |
InChI=1S/C11H11N3OS/c1-9(15)8-16-11-7-12-13-14(11)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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| InChIKey |
ZEWXXPJFFAXSFB-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
Clinical Information about the Compound