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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	SMR000130166
Molecular formula	C22H28N4O3
IUPAC name	N-[1-(cyclopentylcarbamoyl)cyclohexyl]-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
Molecular weight	396.491
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.4
Synonyms	N-[1-(cyclopentylcarbamoyl)cyclohexyl]-N-(2-furfuryl)pyrazinamide ZINC2457437 HMS2355G22 REGID_for_CID_4579040 MLS000519748 SR-01000092677-1 AKOS003636481 N-[1-(cyclopentylcarbamoyl)cyclohexyl]-N-(furan-2-ylmethyl)pyrazine-2-carboxamide CHEMBL1371990 MCULE-7946527939 MolPort-002-957-090 STK149253 BDBM62084 N-[1-[(cyclopentylamino)-oxomethyl]cyclohexyl]-N-(2-furanylmethyl)-2-pyrazinecarboxamide cid_4579040 MLS-0079438.0001 SR-01000092677 AC1NDO8A [ Show all ]
Inchi Key	BXSQZDXBPVRFFZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H28N4O3/c27-20(19-15-23-12-13-24-19)26(16-18-9-6-14-29-18)22(10-4-1-5-11-22)21(28)25-17-7-2-3-8-17/h6,9,12-15,17H,1-5,7-8,10-11,16H2,(H,25,28)
PubChem CID	4579040
ChEMBL	CHEMBL1371990
IUPHAR	N/A
BindingDB	62084
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
35401	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
35400	Kappa-type opioid receptor	P41145	OPRK1	Homo sapiens (Human)	380
35404	Melanin-concentrating hormone receptor 1	Q99705	MCHR1	Homo sapiens (Human)	422
35403	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400
35402	Neuropeptides B/W receptor type 1	P48145	NPBWR1	Homo sapiens (Human)	328

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