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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	CHEMBL452238
Molecular formula	C33H42ClN3O5S
IUPAC name	N-[(2-chlorophenyl)methyl]-2-[[3-methoxy-4-(2-methylpropoxy)phenyl]methyl-[4-(piperidin-1-ylmethyl)phenyl]sulfonylamino]acetamide
Molecular weight	628.225
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	6.0
Synonyms	N-(2-chlorobenzyl)-2-(N-(4-isobutoxy-3-methoxybenzyl)-4-(piperidin-1-ylmethyl)phenylsulfonamido)acetamide BDBM50254458
Inchi Key	AGKIJDSUCAPQKZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C33H42ClN3O5S/c1-25(2)24-42-31-16-13-27(19-32(31)41-3)22-37(23-33(38)35-20-28-9-5-6-10-30(28)34)43(39,40)29-14-11-26(12-15-29)21-36-17-7-4-8-18-36/h5-6,9-16,19,25H,4,7-8,17-18,20-24H2,1-3H3,(H,35,38)
PubChem CID	44569936
ChEMBL	CHEMBL452238
IUPHAR	N/A
BindingDB	50254458
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
4950	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353

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