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Name | Neuropeptide S receptor |
---|---|
Species | Homo sapiens (Human) |
Gene | NPSR1 |
Synonym | G-protein coupled receptor for asthma susceptibility vasopressin receptor-related receptor 1 G protein-coupled receptor 154 PGR14 NPS receptor [ Show all ] |
Disease | Neurological disease |
Length | 371 |
Amino acid sequence | MPANFTEGSFDSSGTGQTLDSSPVACTETVTFTEVVEGKEWGSFYYSFKTEQLITLWVLFVFTIVGNSVVLFSTWRRKKKSRMTFFVTQLAITDSFTGLVNILTDINWRFTGDFTAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQARVLIVIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLTIISIMYGIVIRTIWIKSKTYETVISNCSDGKLCSSYNRGLISKAKIKAIKYSIIIILAFICCWSPYFLFDILDNFNLLPDTQERFYASVIIQNLPALNSAINPLIYCVFSSSISFPCREQRSQDSRMTFRERTERHEMQILSKPEFI |
UniProt | Q6W5P4 |
Protein Data Bank | N/A |
GPCR-HGmod model | Q6W5P4 |
3D structure model | This predicted structure model is from GPCR-EXP Q6W5P4. |
BioLiP | N/A |
Therapeutic Target Database | T20958 |
ChEMBL | CHEMBL5162 |
IUPHAR | 302 |
DrugBank | BE0000948 |
Name | AC1MDGAW |
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Molecular formula | C21H19F4N3OS |
IUPAC name | 1-(4-fluorophenyl)-5-methyl-N-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]pyrazole-4-carboxamide |
Molecular weight | 437.457 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.7 |
Synonyms | HMS2782H17 1-(4-fluorophenyl)-5-methyl-N-(2-{[3-(trifluoromethyl)benzyl]sulfanyl}ethyl)-1H-pyrazole-4-carboxamide MolPort-002-900-539 MCULE-7893706332 1-(4-fluorophenyl)-5-methyl-N-[2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]ethyl]pyrazole-4-carboxamide [ Show all ] |
Inchi Key | AFGMPHHDBDVNME-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H19F4N3OS/c1-14-19(12-27-28(14)18-7-5-17(22)6-8-18)20(29)26-9-10-30-13-15-3-2-4-16(11-15)21(23,24)25/h2-8,11-12H,9-10,13H2,1H3,(H,26,29) |
PubChem CID | 2810788 |
ChEMBL | CHEMBL1507025 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 19952.6 nM | PubChem BioAssay data set | ChEMBL |
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