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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	MLS000082037
Molecular formula	C24H23N3O4
IUPAC name	[2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-(benzimidazol-1-yl)acetate
Molecular weight	417.465
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.0
Synonyms	2-(1-benzimidazolyl)acetic acid [2-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester CHEBI:113109 MolPort-004-017-283 [2-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-(benzimidazol-1-yl)acetate cid_2421595 SR-01000604992 AKOS034464772 MCULE-9590459580 ZINC3305878 2-(benzimidazol-1-yl)acetic acid [2-keto-2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethyl] ester regid3715297 732270-31-4 HMS1766L17 SR-01000604992-2 BDBM37009 [2-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] 2-(benzimidazol-1-yl)ethanoate 2-[1-(4-methoxyphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 2-(1H-1,3-benzodiazol-1-yl)acetate CHEMBL1376266 SMR000062694 AC1M7N7D HMS2342A03 Z56903300 [ Show all ]
Inchi Key	DMMIKXQNMAPFBA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H23N3O4/c1-16-12-20(17(2)27(16)18-8-10-19(30-3)11-9-18)23(28)14-31-24(29)13-26-15-25-21-6-4-5-7-22(21)26/h4-12,15H,13-14H2,1-3H3
PubChem CID	2421595
ChEMBL	CHEMBL1376266
IUPHAR	N/A
BindingDB	37009
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
63830	Galanin receptor type 3	O60755	GALR3	Homo sapiens (Human)	368
470766	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593
63829	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
63828	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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