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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	CHEMBL79369
Molecular formula	C28H34ClN3O2S
IUPAC name	N-[(2S)-2-(3-chlorophenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-N-methylbenzenesulfonamide
Molecular weight	512.109
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	5.8
Synonyms	BDBM50104228 N-[(S)-2-(3-Chloro-phenyl)-4-(4-o-tolyl-piperazin-1-yl)-butyl]-N-methyl-benzenesulfonamide Benzenesulfonamide, N-[(2S)-2-(3-chlorophenyl)-4-[4-(2-methylphenyl)-1-piperazinyl]butyl]-N-methyl- N-[(2S)-2-(3-chlorophenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]butyl]-N-methylbenzenesulfonamide AC1NULYQ SCHEMBL8580471 N-[(2S)-2-(3-chlorophenyl)-4-[4-(o-tolyl)piperazin-1-yl]butyl]-N-methyl-benzenesulfonamide [ Show all ]
Inchi Key	ASNNTFFABYDNRF-RUZDIDTESA-N
Inchi ID	InChI=1S/C28H34ClN3O2S/c1-23-9-6-7-14-28(23)32-19-17-31(18-20-32)16-15-25(24-10-8-11-26(29)21-24)22-30(2)35(33,34)27-12-4-3-5-13-27/h3-14,21,25H,15-20,22H2,1-2H3/t25-/m1/s1
PubChem CID	5482456
ChEMBL	CHEMBL79369
IUPHAR	N/A
BindingDB	50104228
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
13343	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352

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