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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	CHEMBL249235
Molecular formula	C34H45Cl2N7O4S
IUPAC name	4-[1-[[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylamino]cyclopentanecarbonyl]-N'-[3-(dimethylamino)propyl]piperazine-1-carboximidamide
Molecular weight	718.739
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	4.4
Synonyms	BDBM50411247
Inchi Key	GRBKYJHPFBQCDR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H45Cl2N7O4S/c1-23-21-24(2)39-31-25(23)9-7-10-28(31)47-22-26-27(35)11-12-29(30(26)36)48(45,46)40-34(13-5-6-14-34)32(44)42-17-19-43(20-18-42)33(37)38-15-8-16-41(3)4/h7,9-12,21,40H,5-6,8,13-20,22H2,1-4H3,(H2,37,38)
PubChem CID	10079793
ChEMBL	CHEMBL249235
IUPHAR	N/A
BindingDB	50411247
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
103220	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353
103219	B2 bradykinin receptor	O70526	BDKRB2	Cavia porcellus (Guinea pig)	372
103221	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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