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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	CHEMBL1088731
Molecular formula	C25H33N3S
IUPAC name	4-benzhydryl-N-cyclohexyl-1,4-diazepane-1-carbothioamide
Molecular weight	407.62
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	5.3
Synonyms	N/A
Inchi Key	PRXRWYXQNGJSFH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H33N3S/c29-25(26-23-15-8-3-9-16-23)28-18-10-17-27(19-20-28)24(21-11-4-1-5-12-21)22-13-6-2-7-14-22/h1-2,4-7,11-14,23-24H,3,8-10,15-20H2,(H,26,29)
PubChem CID	45277245
ChEMBL	CHEMBL1088731
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

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
267294	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332
267295	Neuromedin-U receptor 1	Q9HB89	NMUR1	Homo sapiens (Human)	426
267293	Neuromedin-U receptor 2	Q9GZQ4	NMUR2	Homo sapiens (Human)	415

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