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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	3,5-dimethyl-4-[(4-nitrophenyl)thio]-1-(phenylsulfonyl)-1H-pyrazole
Molecular formula	C17H15N3O4S2
IUPAC name	1-(benzenesulfonyl)-3,5-dimethyl-4-(4-nitrophenyl)sulfanylpyrazole
Molecular weight	389.444
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	4.2
Synonyms	1-(benzenesulfonyl)-3,5-dimethyl-4-(4-nitrophenyl)sulfanylpyrazole EU-0072762 SMR000186131 AC1LRFYS MLS000578638 ZINC1214138 Oprea1_173496 1-(benzenesulfonyl)-3,5-dimethyl-4-[(4-nitrophenyl)sulfanyl]-1H-pyrazole HMS2486K07 SR-01000443922 AC1Q2PKT MolPort-001-817-877 CHEMBL1518470 REGID_for_CID_1368271 MCULE-4858937497 SR-01000443922-1 AKOS001631685 Oprea1_051797 [ Show all ]
Inchi Key	JTPVYYMJQNPEDF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H15N3O4S2/c1-12-17(25-15-10-8-14(9-11-15)20(21)22)13(2)19(18-12)26(23,24)16-6-4-3-5-7-16/h3-11H,1-2H3
PubChem CID	1368271
ChEMBL	CHEMBL1518470
IUPHAR	N/A
BindingDB	N/A
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
159688	Lutropin-choriogonadotropic hormone receptor	P22888	LHCGR	Homo sapiens (Human)	699
159689	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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