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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	MLS000087136
Molecular formula	C23H21ClN4O4
IUPAC name	N-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide
Molecular weight	452.895
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.4
Synonyms	N-[1-(4-chlorobenzyl)-5-methyl-1H-pyrazol-3-yl]-5-(3,4-dimethoxyphenyl)isoxazole-3-carboxamide [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]-N-{1-[(4-chlorophenyl)methyl]-5-methylp yrazol-3-yl}carboxamide CHEMBL1401044 HMS2435N12 N-[1-[(4-chlorophenyl)methyl]-5-methyl-pyrazol-3-yl]-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide AC1MMDSW MLS001367838 ST50677527 CHEBI:116740 cid_3237184 N-[1-(4-chlorobenzyl)-5-methyl-pyrazol-3-yl]-5-(3,4-dimethoxyphenyl)isoxazole-3-carboxamide MCULE-4407649448 N-[1-[(4-chlorophenyl)methyl]-5-methylpyrazol-3-yl]-5-(3,4-dimethoxyphenyl)-1,2-oxazole-3-carboxamide AKOS001797546 MolPort-006-843-487 ZINC4111483 EU-0057165 N-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]-5-(3,4-dimethoxyphenyl)-3-isoxazolecarboxamide SMR000023359 BDBM37291 [ Show all ]
Inchi Key	AAXMQQXWRPGRCS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H21ClN4O4/c1-14-10-22(26-28(14)13-15-4-7-17(24)8-5-15)25-23(29)18-12-20(32-27-18)16-6-9-19(30-2)21(11-16)31-3/h4-12H,13H2,1-3H3,(H,25,26,29)
PubChem CID	3237184
ChEMBL	CHEMBL1401044
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
604	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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