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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	MLS002473569
Molecular formula	C22H18N2O3S2
IUPAC name	5-[2-[5-methoxy-2-(4-methylsulfonylphenyl)-1-benzothiophen-3-yl]ethynyl]-1-methylimidazole
Molecular weight	422.517
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	4.0
Synonyms	5-[2-[2-(4-mesylphenyl)-5-methoxy-benzothiophen-3-yl]ethynyl]-1-methyl-imidazole HMS2200F15 SMR001397736 CHEMBL1707272 5-[2-[5-methoxy-2-(4-methylsulfonylphenyl)-1-benzothiophen-3-yl]ethynyl]-1-methyl-imidazole HMS3331D09 BDBM88491 cid_44202221 5-[2-[5-methoxy-2-(4-methylsulfonylphenyl)-1-benzothiophen-3-yl]ethynyl]-1-methylimidazole [ Show all ]
Inchi Key	AAHMFTBCVJDHBJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H18N2O3S2/c1-24-14-23-13-16(24)6-10-19-20-12-17(27-2)7-11-21(20)28-22(19)15-4-8-18(9-5-15)29(3,25)26/h4-5,7-9,11-14H,1-3H3
PubChem CID	44202221
ChEMBL	CHEMBL1707272
IUPHAR	N/A
BindingDB	88491
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
207	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
206	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332

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