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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	AC1MCK4S
Molecular formula	C17H19F2N5O2S
IUPAC name	methyl 5-[(tert-butylcarbamothioylhydrazinylidene)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate
Molecular weight	395.429
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	2.9
Synonyms	GTPL9741 methyl-5-[(t-butylcarbamothioylhydrazinylidene)-methyl]-1-(2,4-difluorophenyl)-pyrazole-4-carboxylate CID2745687 HMS2800O20 compound 13 [PMID: 23888932] methyl 5-[(tert-butylcarbamothioylhydrazinylidene)methyl]-1-(2,4-difluorophenyl)pyrazole-4-carboxylate [ Show all ]
Inchi Key	CYNLZIBKERMMOA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H19F2N5O2S/c1-17(2,3)22-16(27)23-20-9-14-11(15(25)26-4)8-21-24(14)13-6-5-10(18)7-12(13)19/h5-9H,1-4H3,(H2,22,23,27)
PubChem CID	2745687
ChEMBL	N/A
IUPHAR	9741
BindingDB	61632
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
53711	G-protein coupled receptor 35	Q9HC97	GPR35	Homo sapiens (Human)	309
53712	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319

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