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Name | Adenosine receptor A2a |
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Species | Rattus norvegicus (Rat) |
Gene | Adora2a |
Synonym | A2-AR A2A receptor adenosine receptor A2a RDC8 |
Disease | N/A for non-human GPCRs |
Length | 410 |
Amino acid sequence | MGSSVYITVELAIAVLAILGNVLVCWAVWINSNLQNVTNFFVVSLAAADIAVGVLAIPFAITISTGFCAACHGCLFFACFVLVLTQSSIFSLLAIAIDRYIAIRIPLRYNGLVTGVRAKGIIAICWVLSFAIGLTPMLGWNNCSQKDGNSTKTCGEGRVTCLFEDVVPMNYMVYYNFFAFVLLPLLLMLAIYLRIFLAARRQLKQMESQPLPGERTRSTLQKEVHAAKSLAIIVGLFALCWLPLHIINCFTFFCSTCRHAPPWLMYLAIILSHSNSVVNPFIYAYRIREFRQTFRKIIRTHVLRRQEPFQAGGSSAWALAAHSTEGEQVSLRLNGHPLGVWANGSATHSGRRPNGYTLGLGGGGSAQGSPRDVELPTQERQEGQEHPGLRGHLVQARVGASSWSSEFAPS |
UniProt | P30543 |
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 | CHEMBL302 |
IUPHAR | 19 |
DrugBank | N/A |
Name | CHEMBL337503 |
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Molecular formula | C30H31N2O5S+ |
IUPAC name | ethyl 4-[2-(1,3-dioxoisoindol-2-yl)ethyl]-6-ethyl-5-ethylsulfanylcarbonyl-1-methyl-2-phenylpyridin-1-ium-3-carboxylate |
Molecular weight | 531.647 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 5.4 |
Synonyms | 1-Methyl-2-ethyl-4-[2-(1,3-dihydro-1,3-dioxo-2H-isoindole-2-yl)ethyl]-3-[(ethylthio)carbonyl]-5-(ethoxycarbonyl)-6-phenylpyridinium BDBM50081670 4-[2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-ethyl]-3-ethoxycarbonyl-6-ethyl-5-ethylsulfanylcarbonyl-1-methyl-2-phenyl-pyridinium; iodide CHEMBL1184182 |
Inchi Key | ALFKNYIWXLVKFC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H31N2O5S/c1-5-23-24(30(36)38-7-3)22(17-18-32-27(33)20-15-11-12-16-21(20)28(32)34)25(29(35)37-6-2)26(31(23)4)19-13-9-8-10-14-19/h8-16H,5-7,17-18H2,1-4H3/q+1 |
PubChem CID | 10722997 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50081670 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 2150.0 nM | PMID10514293 | BindingDB |
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