You can:
Name | Adenosine receptor A1 |
---|---|
Species | Cavia porcellus (Guinea pig) |
Gene | ADORA1 |
Synonym | N/A |
Disease | N/A for non-human GPCRs |
Length | 326 |
Amino acid sequence | MPHSVSAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIASLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAAVAIAGCWILSLVVGLTPMFGWNNLSKIEMAWAANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLSKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCHKPTILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPEPPIDEDLPEEKVDD |
UniProt | P47745 |
Protein Data Bank | N/A |
GPCR-HGmod model | N/A |
3D structure model | No available structures or models |
BioLiP | N/A |
Therapeutic Target Database | N/A |
ChEMBL | CHEMBL2304404 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL344992 |
---|---|
Molecular formula | C21H25FN4O2 |
IUPAC name | 8-[cyclopropyl-(4-fluorophenyl)methyl]-1,3-dipropyl-7H-purine-2,6-dione |
Molecular weight | 384.455 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 5.6 |
Synonyms | SCHEMBL7269736 8-[Cyclopropyl-(4-fluoro-phenyl)-methyl]-1,3-dipropyl-3,7-dihydro-purine-2,6-dione 1,3-Dipropyl-8-(alpha-cyclopropyl-4-fluorobenzyl)xanthine BDBM50011225 |
Inchi Key | GDGUEXHQRZLZNJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H25FN4O2/c1-3-11-25-19-17(20(27)26(12-4-2)21(25)28)23-18(24-19)16(13-5-6-13)14-7-9-15(22)10-8-14/h7-10,13,16H,3-6,11-12H2,1-2H3,(H,23,24) |
PubChem CID | 15010011 |
ChEMBL | CHEMBL344992 |
IUPHAR | N/A |
BindingDB | 50011225 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 250.0 nM | PMID1992150 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218