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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	CHEMBL218744
Molecular formula	C23H29BrN6O4S
IUPAC name	2-(2-bromophenyl)-1-cyano-3-[2-hydroxy-3-(3-morpholin-4-ylpentan-3-ylsulfamoyl)phenyl]guanidine
Molecular weight	565.487
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	4.7
Synonyms	3-(2-bromophenyl)-2-cyano-1-(2-hydroxy-3-{[3-(morpholin-4-yl)pentan-3-yl]sulfamoyl}phenyl)guanidine BDBM50193982
Inchi Key	GULGFHPSYNQMBP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H29BrN6O4S/c1-3-23(4-2,30-12-14-34-15-13-30)29-35(32,33)20-11-7-10-19(21(20)31)28-22(26-16-25)27-18-9-6-5-8-17(18)24/h5-11,29,31H,3-4,12-15H2,1-2H3,(H2,26,27,28)
PubChem CID	44419483
ChEMBL	CHEMBL218744
IUPHAR	N/A
BindingDB	50193982
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
105697	C-X-C chemokine receptor type 1	P25024	CXCR1	Homo sapiens (Human)	350
105698	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360

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