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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	CHEMBL538732
Molecular formula	C29H27BrCl3N5O4
IUPAC name	4-[(E)-3-[[2-[3-[(3-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)oxymethyl]-2,4-dichloro-N-methylanilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide;hydrochloride
Molecular weight	695.82
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	None
Synonyms	SCHEMBL8567356
Inchi Key	CMEYURXQZDMCTC-FNXZNAJJSA-N
Inchi ID	InChI=1S/C29H26BrCl2N5O4.ClH/c1-17-27(30)37-14-4-5-23(28(37)35-17)41-16-20-21(31)11-12-22(26(20)32)36(3)25(39)15-34-24(38)13-8-18-6-9-19(10-7-18)29(40)33-2;/h4-14H,15-16H2,1-3H3,(H,33,40)(H,34,38);1H/b13-8+;
PubChem CID	18923352
ChEMBL	CHEMBL538732
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available.

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
45269	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391
45270	B2 bradykinin receptor	O70526	BDKRB2	Cavia porcellus (Guinea pig)	372

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