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Name | Histamine H2 receptor |
---|---|
Species | Homo sapiens (Human) |
Gene | HRH2 |
Synonym | HH2R H2R Gastric receptor I H2 receptor |
Disease | Ulcerative colitis Pain Peptic ulcer Gastroesophageal reflux disease Gastric ulcer [ Show all ] |
Length | 359 |
Amino acid sequence | MAPNGTASSFCLDSTACKITITVVLAVLILITVAGNVVVCLAVGLNRRLRNLTNCFIVSLAITDLLLGLLVLPFSAIYQLSCKWSFGKVFCNIYTSLDVMLCTASILNLFMISLDRYCAVMDPLRYPVLVTPVRVAISLVLIWVISITLSFLSIHLGWNSRNETSKGNHTTSKCKVQVNEVYGLVDGLVTFYLPLLIMCITYYRIFKVARDQAKRINHISSWKAATIREHKATVTLAAVMGAFIICWFPYFTAFVYRGLRGDDAINEVLEAIVLWLGYANSALNPILYAALNRDFRTGYQQLFCCRLANRNSHKTSLRSNASQLSRTQSREPRQQEEKPLKLQVWSGTEVTAPQGATDR |
UniProt | P25021 |
Protein Data Bank | N/A |
GPCR-HGmod model | P25021 |
3D structure model | This predicted structure model is from GPCR-EXP P25021. |
BioLiP | N/A |
Therapeutic Target Database | T30985 |
ChEMBL | CHEMBL1941 |
IUPHAR | 263 |
DrugBank | BE0000112 |
Name | CHEMBL3220653 |
---|---|
Molecular formula | C16H23N9S |
IUPAC name | 2-[4-[(5-amino-1H-1,2,4-triazol-3-yl)amino]butyl]-1-cyano-3-(2-phenylsulfanylethyl)guanidine |
Molecular weight | 373.483 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 5 |
XlogP | 2.2 |
Synonyms | N/A |
Inchi Key | BTLGXJUDLJOGSO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H23N9S/c17-12-22-15(21-10-11-26-13-6-2-1-3-7-13)19-8-4-5-9-20-16-23-14(18)24-25-16/h1-3,6-7H,4-5,8-11H2,(H2,19,21,22)(H4,18,20,23,24,25) |
PubChem CID | 90667250 |
ChEMBL | CHEMBL3220653 |
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 |
---|---|---|---|
Intrinsic activity | -0.09 - | MedChemComm, (2014) 5:1:72 | ChEMBL |
pKb | >5.0 - | MedChemComm, (2014) 5:1:72 | ChEMBL |
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