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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	CHEMBL49954
Molecular formula	C26H27ClN4O3S
IUPAC name	2-butyl-5-chloro-3-[[4-[[(2S)-2-pyrrol-1-yl-3-thiophen-2-ylpropanoyl]amino]phenyl]methyl]imidazole-4-carboxylic acid
Molecular weight	511.037
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	5.6
Synonyms	2-Butyl-5-chloro-3-[4-(2-pyrrol-1-yl-3-thiophen-2-yl-propionylamino)-benzyl]-3H-imidazole-4-carboxylic acid 1-[4-[[(2S)-2-(1H-Pyrrol-1-yl)-3-(2-thienyl)-1-oxopropyl]amino]benzyl]-2-butyl-4-chloro-1H-imidazole-5-carboxylic acid BDBM50047956
Inchi Key	FUKJLFAEUAUNJO-NRFANRHFSA-N
Inchi ID	InChI=1S/C26H27ClN4O3S/c1-2-3-8-22-29-24(27)23(26(33)34)31(22)17-18-9-11-19(12-10-18)28-25(32)21(30-13-4-5-14-30)16-20-7-6-15-35-20/h4-7,9-15,21H,2-3,8,16-17H2,1H3,(H,28,32)(H,33,34)/t21-/m0/s1
PubChem CID	44293911
ChEMBL	CHEMBL49954
IUPHAR	N/A
BindingDB	50047956
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
87500	Type-1B angiotensin II receptor	P29089	Agtr1b	Rattus norvegicus (Rat)	359

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