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Name | 1-tert-butyl-3-methyl-4-[(4-methylphenyl)sulfonyl]-1H-pyrazol-5-yl thiophene-2-carboxylate |
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Molecular formula | C20H22N2O4S2 |
IUPAC name | [2-tert-butyl-5-methyl-4-(4-methylphenyl)sulfonylpyrazol-3-yl] thiophene-2-carboxylate |
Molecular weight | 418.526 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 4.4 |
Synonyms | MLS000090765 AKOS001197585 SMR000025368 HMS2275I16 MLS001367833 [ Show all ] |
Inchi Key | AGRYPPPEOJFIBA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H22N2O4S2/c1-13-8-10-15(11-9-13)28(24,25)17-14(2)21-22(20(3,4)5)18(17)26-19(23)16-7-6-12-27-16/h6-12H,1-5H3 |
PubChem CID | 3236657 |
ChEMBL | CHEMBL1600209 |
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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5159 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
5158 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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