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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 | MLS000551396 |
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Molecular formula | C22H20BrClN4O3 |
IUPAC name | 4-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]-4-oxobutanoic acid |
Molecular weight | 503.781 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | 4-[4-[6-bromanyl-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]-4-oxidanylidene-butanoic acid AC1LR1RG 4-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazino]-4-keto-butyric acid Oprea1_609645 4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazinyl}-4-oxobutanoic aci d [ Show all ] |
Inchi Key | CJWRZEGXLDKDGH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H20BrClN4O3/c23-14-5-6-18-16(13-14)21(15-3-1-2-4-17(15)24)26-22(25-18)28-11-9-27(10-12-28)19(29)7-8-20(30)31/h1-6,13H,7-12H2,(H,30,31) |
PubChem CID | 1386650 |
ChEMBL | CHEMBL1333441 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Potency | 12589.3 nM | PubChem BioAssay data set | ChEMBL |
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