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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	MLS000058898
Molecular formula	C13H22N2O2S
IUPAC name	3-butan-2-yl-5-ethyl-6-hydroxy-2-propylsulfanylpyrimidin-4-one
Molecular weight	270.391
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.3
Synonyms	1-butan-2-yl-5-ethyl-6-oxidanyl-2-propylsulfanyl-pyrimidin-4-one CHEBI:113003 cid_2842565 SMR000069467 1-butan-2-yl-5-ethyl-6-hydroxy-2-(propylthio)-4-pyrimidinone BDBM76107 MCULE-7914868370 3-sec-butyl-5-ethyl-6-hydroxy-2-(propylthio)-4(3H)-pyrimidinone MolPort-002-113-936 AB00081660-01 HMS1582N07 1-butan-2-yl-5-ethyl-6-hydroxy-2-propylsulfanylpyrimidin-4-one Cambridge id 5344703 MLS-0014564.0001 5-ethyl-6-hydroxy-2-(propylthio)-1-sec-butyl-pyrimidin-4-one CHEMBL1329339 Oprea1_738097 AC1MDT7W HMS2444A13 [ Show all ]
Inchi Key	BKSVBBOOWFNSIG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H22N2O2S/c1-5-8-18-13-14-11(16)10(7-3)12(17)15(13)9(4)6-2/h9,16H,5-8H2,1-4H3
PubChem CID	135458801
ChEMBL	CHEMBL1329339
IUPHAR	N/A
BindingDB	76107
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
558074	Apelin receptor	P35414	APLNR	Homo sapiens (Human)	380
558075	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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