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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 | CHEMBL75597 |
---|---|
Molecular formula | C21H26N4O2 |
IUPAC name | 7-methyl-8-[(E)-3-phenylprop-2-enyl]-1,3-dipropylpurine-2,6-dione |
Molecular weight | 366.465 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 4.0 |
Synonyms | 1,3-Dipropyl-7-methyl-8-[(E)-3-phenyl-2-propenyl]xanthine BDBM50006701 7-Methyl-8-(3-phenyl-allyl)-1,3-dipropyl-3,7-dihydro-purine-2,6-dione |
Inchi Key | AFJGZAMGBLWZAS-FMIVXFBMSA-N |
Inchi ID | InChI=1S/C21H26N4O2/c1-4-14-24-19-18(20(26)25(15-5-2)21(24)27)23(3)17(22-19)13-9-12-16-10-7-6-8-11-16/h6-12H,4-5,13-15H2,1-3H3/b12-9+ |
PubChem CID | 15170855 |
ChEMBL | CHEMBL75597 |
IUPHAR | N/A |
BindingDB | 50006701 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 3500.0 nM | PMID1613758 | BindingDB,ChEMBL |
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