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Name | Neuropeptide S receptor |
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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 | SMR000131285 |
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Molecular formula | C23H20ClN3O2S |
IUPAC name | (E)-3-[(4-chlorophenyl)methylsulfanyl]-2-cyano-N-(furan-2-ylmethyl)-3-(2-methylanilino)prop-2-enamide |
Molecular weight | 437.942 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 5.6 |
Synonyms | HMS663C07 ZINC3058889 (2E)-3-[(4-chlorobenzyl)thio]-2-cyano-N-(2-furylmethyl)-3-[(2-methylphenyl)amino]acrylamide MolPort-007-916-230 CHEMBL1541531 [ Show all ] |
Inchi Key | KMKVIZIVVPUGGP-BSYVCWPDSA-N |
Inchi ID | InChI=1S/C23H20ClN3O2S/c1-16-5-2-3-7-21(16)27-23(30-15-17-8-10-18(24)11-9-17)20(13-25)22(28)26-14-19-6-4-12-29-19/h2-12,27H,14-15H2,1H3,(H,26,28)/b23-20+ |
PubChem CID | 9551202 |
ChEMBL | CHEMBL1541531 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 10000.0 nM | PubChem BioAssay data set | ChEMBL |
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