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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	CHEMBL1716544
Molecular formula	C21H20FN3O3
IUPAC name	4-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl-methylamino]-4-oxobutanoic acid
Molecular weight	381.407
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.4
Synonyms	MLS000394040 AC1M2P0F STL488711 3-({[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}(methyl)carbamoyl)propanoic acid HMS2556N08 MolPort-004-275-090 AKOS024300985 Z57008904 4-[[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl-methylamino]-4-oxobutanoic acid 882216-84-4 MCULE-9254122400 SMR000241575 BDBM50187506 ZINC2657840 4-[{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methyl}(methyl)amino]-4-oxobutanoic acid HMS1771H14 [ Show all ]
Inchi Key	BBMMUTCDVDPEJZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20FN3O3/c1-24(19(26)11-12-20(27)28)13-16-14-25(18-5-3-2-4-6-18)23-21(16)15-7-9-17(22)10-8-15/h2-10,14H,11-13H2,1H3,(H,27,28)
PubChem CID	2121575
ChEMBL	CHEMBL1716544
IUPHAR	N/A
BindingDB	50187506
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
522040	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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