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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	CHEMBL1272096
Molecular formula	C17H15N5O3S2
IUPAC name	2-[[4-(furan-2-ylmethyl)-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide
Molecular weight	401.459
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	2.4
Synonyms	BDBM50417241 HMS2337E23 2-[4-Furan-2-ylmethyl-5-(2-methyl-furan-3-yl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-thiazol-2-yl-acetamide SMR000005732 AC1LDCFN MLS000033048 2-[[4-(furan-2-ylmethyl)-5-(2-methylfuran-3-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-thiazol-2-yl)acetamide ASN 05918659 Oprea1_298434 [ Show all ]
Inchi Key	AKOLLOOKOCBFDX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H15N5O3S2/c1-11-13(4-7-24-11)15-20-21-17(22(15)9-12-3-2-6-25-12)27-10-14(23)19-16-18-5-8-26-16/h2-8H,9-10H2,1H3,(H,18,19,23)
PubChem CID	645882
ChEMBL	CHEMBL1272096
IUPHAR	N/A
BindingDB	50417241
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
7740	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
7739	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444
7741	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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