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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	CHEMBL1760338
Molecular formula	C21H21ClN4O2
IUPAC name	[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
Molecular weight	396.875
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.9
Synonyms	MolPort-008-325-038 BDBM50341075 [5-(4-chlorophenyl)-1H-pyrazol-3-yl][4-(2-methoxyphenyl)piperazin-1-yl]methanone (3-(4-chlorophenyl)-1H-pyrazol-5-yl)(4-(2-methoxyphenyl)piperazin-1-yl)methanone MCULE-2901872332 AKOS001920631 STK879677 1-{[3-(4-chlorophenyl)-1H-pyrazol-5-yl]carbonyl}-4-(2-methoxyphenyl)piperazine MolPort-007-747-826 AKOS005636717 ZINC14049704 [ Show all ]
Inchi Key	DEYOMMQLWMIBRN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H21ClN4O2/c1-28-20-5-3-2-4-19(20)25-10-12-26(13-11-25)21(27)18-14-17(23-24-18)15-6-8-16(22)9-7-15/h2-9,14H,10-13H2,1H3,(H,23,24)
PubChem CID	20906619
ChEMBL	CHEMBL1760338
IUPHAR	N/A
BindingDB	50341075
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
58280	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
58282	Neuromedin-K receptor	P16177	Tacr3	Rattus norvegicus (Rat)	452
58281	Substance-K receptor	P21452	TACR2	Homo sapiens (Human)	398
58279	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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