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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL83863
Molecular formula	C22H21ClN4
IUPAC name	2-(3-chlorophenyl)-5,6-dimethyl-7-[(1R)-1-phenylethyl]pyrrolo[2,3-d]pyrimidin-4-amine
Molecular weight	376.888
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.3
Synonyms	2-(3-Chlorophenyl)-5,6-dimethyl-7-[(R)-alpha-methylbenzyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine 2-(3-Chloro-phenyl)-5,6-dimethyl-7-((R)-1-phenyl-ethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine BDBM50051657
Inchi Key	AUONECWBDHODLJ-OAHLLOKOSA-N
Inchi ID	InChI=1S/C22H21ClN4/c1-13-14(2)27(15(3)16-8-5-4-6-9-16)22-19(13)20(24)25-21(26-22)17-10-7-11-18(23)12-17/h4-12,15H,1-3H3,(H2,24,25,26)/t15-/m1/s1
PubChem CID	9929597
ChEMBL	CHEMBL83863
IUPHAR	N/A
BindingDB	50051657
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
14841	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
14842	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410

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