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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	CHEMBL48168
Molecular formula	C30H33ClN4O3
IUPAC name	2-[2-butyl-5-chloro-3-[[4-[[(2S)-2-(2-methylpyrrol-1-yl)-3-phenylpropanoyl]amino]phenyl]methyl]imidazol-4-yl]acetic acid
Molecular weight	533.069
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	5.9
Synonyms	1-[4-[[(2S)-2-(2-Methyl-1H-pyrrol-1-yl)-3-phenyl-1-oxopropyl]amino]benzyl]-2-butyl-4-chloro-1H-imidazole-5-acetic acid (2-Butyl-5-chloro-3-{4-[2-(2-methyl-pyrrol-1-yl)-3-phenyl-propionylamino]-benzyl}-3H-imidazol-4-yl)-acetic acid BDBM50047943
Inchi Key	GKSXDFYDFXSKQV-SANMLTNESA-N
Inchi ID	InChI=1S/C30H33ClN4O3/c1-3-4-12-27-33-29(31)25(19-28(36)37)35(27)20-23-13-15-24(16-14-23)32-30(38)26(34-17-8-9-21(34)2)18-22-10-6-5-7-11-22/h5-11,13-17,26H,3-4,12,18-20H2,1-2H3,(H,32,38)(H,36,37)/t26-/m0/s1
PubChem CID	44294031
ChEMBL	CHEMBL48168
IUPHAR	N/A
BindingDB	50047943
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
98943	Type-1B angiotensin II receptor	P29089	Agtr1b	Rattus norvegicus (Rat)	359

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