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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	CHEMBL344021
Molecular formula	C33H34N4O6
IUPAC name	4-[(E)-3-[[2-[2,4-dimethoxy-N-methyl-3-[(2-methylquinolin-8-yl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide
Molecular weight	582.657
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	4.1
Synonyms	4-{(E)-2-[({[2,4-Dimethoxy-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-methyl-carbamoyl}-methyl)-carbamoyl]-vinyl}-N-methyl-benzamide BDBM50067924 SCHEMBL8364458
Inchi Key	GQOBRKVINZPHJP-LDADJPATSA-N
Inchi ID	InChI=1S/C33H34N4O6/c1-21-9-13-23-7-6-8-28(31(23)36-21)43-20-25-27(41-4)17-16-26(32(25)42-5)37(3)30(39)19-35-29(38)18-12-22-10-14-24(15-11-22)33(40)34-2/h6-18H,19-20H2,1-5H3,(H,34,40)(H,35,38)/b18-12+
PubChem CID	10579159
ChEMBL	CHEMBL344021
IUPHAR	N/A
BindingDB	50067924
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
102804	B2 bradykinin receptor	O70526	BDKRB2	Cavia porcellus (Guinea pig)	372
102805	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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