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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	SMR000021507
Molecular formula	C23H20FN5O4S
IUPAC name	N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
Molecular weight	481.502
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	3.1
Synonyms	MolPort-003-413-167 N-[[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide ZINC3632658 F0772-2451 MLS000044097 N-{[5-({2-[(4-fluorophenyl)amino]-2-oxoethyl}thio)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl}-2-furamide AKOS001759961 N-((5-((2-((4-fluorophenyl)amino)-2-oxoethyl)thio)-4-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl)methyl)furan-2-carboxamide SR-01000542269 CHEMBL1309064 N-[[5-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-furamide AB00156025-10 HMS2314K18 MLS000878897 Oprea1_684909 BDBM37736 N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide SR-01000542269-1 cid_3243318 MCULE-5750553865 N-[[5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]-2-furancarboxamide AC1MMRKR [ Show all ]
Inchi Key	AYACUCITSRXJPL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H20FN5O4S/c1-32-18-6-3-2-5-17(18)29-20(13-25-22(31)19-7-4-12-33-19)27-28-23(29)34-14-21(30)26-16-10-8-15(24)9-11-16/h2-12H,13-14H2,1H3,(H,25,31)(H,26,30)
PubChem CID	3243318
ChEMBL	CHEMBL1309064
IUPHAR	N/A
BindingDB	37736
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
17266	fMet-Leu-Phe receptor	P21462	FPR1	Homo sapiens (Human)	350
17265	N-formyl peptide receptor 2	P25090	FPR2	Homo sapiens (Human)	351

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