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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	CHEMBL94988
Molecular formula	C25H25ClN4O2S2
IUPAC name	N-[4-[(8aS)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl]quinolin-6-yl]-5-chloro-3-methyl-1-benzothiophene-2-sulfonamide
Molecular weight	513.071
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	5.5
Synonyms	N-[4-[(8aalpha)-Octahydropyrrolo[1,2-a]pyrazine-2-yl]-6-quinolinyl]-3-methyl-5-chlorobenzo[b]thiophene-2-sulfonamide BDBM50219095
Inchi Key	AGPJNLXSJLVUTM-IBGZPJMESA-N
Inchi ID	InChI=1S/C25H25ClN4O2S2/c1-16-20-13-17(26)4-7-24(20)33-25(16)34(31,32)28-18-5-6-22-21(14-18)23(8-9-27-22)30-12-11-29-10-2-3-19(29)15-30/h4-9,13-14,19,28H,2-3,10-12,15H2,1H3/t19-/m0/s1
PubChem CID	44328732
ChEMBL	CHEMBL94988
IUPHAR	N/A
BindingDB	50219095
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
5096	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440

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