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Name | 1-tert-butyl-3-methyl-4-[(2-nitrophenyl)thio]-1H-pyrazol-5-yl acetate |
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Molecular formula | C16H19N3O4S |
IUPAC name | [2-tert-butyl-5-methyl-4-(2-nitrophenyl)sulfanylpyrazol-3-yl] acetate |
Molecular weight | 349.405 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 3.5 |
Synonyms | 1-(tert-butyl)-3-methyl-4-((2-nitrophenyl)thio)-1H-pyrazol-5-yl acetate F0569-0568 ZINC212756 AC1LFN7A MLS000729835 [ Show all ] |
Inchi Key | GAFJIGVVQLCBPY-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H19N3O4S/c1-10-14(24-13-9-7-6-8-12(13)19(21)22)15(23-11(2)20)18(17-10)16(3,4)5/h6-9H,1-5H3 |
PubChem CID | 756445 |
ChEMBL | CHEMBL1412994 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
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91571 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
91572 | Thyrotropin-releasing hormone receptor | P34981 | TRHR | Homo sapiens (Human) | 398 |
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