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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	CHEMBL111320
Molecular formula	C22H30ClN3O3S
IUPAC name	(1R)-1-(3-chlorophenyl)-2-[2-[4-(cyclohexylsulfamoylamino)phenyl]ethylamino]ethanol
Molecular weight	452.01
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	3.7
Synonyms	N''-[4-(2-{[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino}ethyl)phenyl]-N-cyclohexylsulfamide SCHEMBL6335090 BDBM50147452
Inchi Key	BFKNOKSSNSNADR-QFIPXVFZSA-N
Inchi ID	InChI=1S/C22H30ClN3O3S/c23-19-6-4-5-18(15-19)22(27)16-24-14-13-17-9-11-21(12-10-17)26-30(28,29)25-20-7-2-1-3-8-20/h4-6,9-12,15,20,22,24-27H,1-3,7-8,13-14,16H2/t22-/m0/s1
PubChem CID	10182494
ChEMBL	CHEMBL111320
IUPHAR	N/A
BindingDB	50147452
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
22391	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
22392	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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