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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	CHEMBL298158
Molecular formula	C35H42N6O2
IUPAC name	1-(5-cyclohexyl-2-oxo-1-propyl-3H-1,4-benzodiazepin-3-yl)-3-[4-(4-phenylpiperazin-1-yl)phenyl]urea
Molecular weight	578.761
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	6.5
Synonyms	BDBM50127444 1-(5-Cyclohexyl-2-oxo-1-propyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-3-[4-(4-phenyl-piperazin-1-yl)-phenyl]-urea
Inchi Key	CLXUEGHSINIKNK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C35H42N6O2/c1-2-21-41-31-16-10-9-15-30(31)32(26-11-5-3-6-12-26)37-33(34(41)42)38-35(43)36-27-17-19-29(20-18-27)40-24-22-39(23-25-40)28-13-7-4-8-14-28/h4,7-10,13-20,26,33H,2-3,5-6,11-12,21-25H2,1H3,(H2,36,38,43)
PubChem CID	10940858
ChEMBL	CHEMBL298158
IUPHAR	N/A
BindingDB	50127444
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
45091	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353

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