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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	CHEMBL558838
Molecular formula	C21H28N6O
IUPAC name	5-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-N,N,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine
Molecular weight	380.496
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	2.9
Synonyms	BDBM50295930 N,N,6-Trimethyl-5-[[4-(2-methoxyphenyl)piperazino]methyl]-7H-pyrrolo[2,3-d]pyrimidine-2-amine 5-((4-(2-methoxyphenyl)piperazin-1-yl)methyl)-N,N,6-trimethyl-7H-pyrrolo[2,3-d]pyrimidin-2-amine
Inchi Key	ADAZZWTYEBRRHE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H28N6O/c1-15-17(16-13-22-21(25(2)3)24-20(16)23-15)14-26-9-11-27(12-10-26)18-7-5-6-8-19(18)28-4/h5-8,13H,9-12,14H2,1-4H3,(H,22,23,24)
PubChem CID	16121920
ChEMBL	CHEMBL558838
IUPHAR	N/A
BindingDB	50295930
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
2100	D(1A) dopamine receptor	Q95136	DRD1	Bos taurus (Bovine)	446
441750	D(1A) dopamine receptor	P50130	DRD1	Sus scrofa (Pig)	446
2098	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
2099	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
521507	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467

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