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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	MLS000056239
Molecular formula	C21H22N2O3S
IUPAC name	N-[2-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethoxy]phenyl]acetamide
Molecular weight	382.478
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.3
Synonyms	SCHEMBL17456958 BDBM37016 MLS001332920 SR-01000604192-2 cid_2524461 N-[2-[2-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-keto-ethoxy]phenyl]acetamide N-[2-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxoethoxy]phenyl]acetamide Z19816924 AC1M90HI MCULE-4350406184 SMR000068045 MolPort-004-077-270 SR-01000604192-4 HMS1729F12 N-[2-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-oxoethoxy]phenyl]acetamide regid3716460 ZINC3405706 AKOS033713132 SR-01000604192 CHEMBL1320669 N-[2-(2-{2,5-dimethyl-1-[(thiophen-2-yl)methyl]-1H-pyrrol-3-yl}-2-oxoethoxy)phenyl]acetamide N-[2-[2-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-oxidanylidene-ethoxy]phenyl]ethanamide SR-01000604192-5 851819-19-7 HMS2372N03 [ Show all ]
Inchi Key	JXHFEOAFQXPYIJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H22N2O3S/c1-14-11-18(15(2)23(14)12-17-7-6-10-27-17)20(25)13-26-21-9-5-4-8-19(21)22-16(3)24/h4-11H,12-13H2,1-3H3,(H,22,24)
PubChem CID	2524461
ChEMBL	CHEMBL1320669
IUPHAR	N/A
BindingDB	37016
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
162325	Galanin receptor type 2	O43603	GALR2	Homo sapiens (Human)	387
162323	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
162324	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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