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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	CHEMBL280869
Molecular formula	C33H29Cl2N3O5S
IUPAC name	N-[2,4-dichloro-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-N-methyl-2-[1-methyl-5-(4-methylsulfonylbenzoyl)pyrrol-2-yl]acetamide
Molecular weight	650.571
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	6.0
Synonyms	N-[2,4-Dichloro-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-2-[5-(4-methanesulfonyl-benzoyl)-1-methyl-1H-pyrrol-2-yl]-N-methyl-acetamide SCHEMBL4601565 BDBM50126242
Inchi Key	AXVRXNVRRZNSLP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C33H29Cl2N3O5S/c1-20-8-9-21-6-5-7-29(32(21)36-20)43-19-25-26(34)15-17-27(31(25)35)38(3)30(39)18-23-12-16-28(37(23)2)33(40)22-10-13-24(14-11-22)44(4,41)42/h5-17H,18-19H2,1-4H3
PubChem CID	22288578
ChEMBL	CHEMBL280869
IUPHAR	N/A
BindingDB	50126242
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
17161	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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