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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	CHEMBL544622
Molecular formula	C38H42N6O6
IUPAC name	4-[[2-[[(E)-3-[4-(dimethylcarbamoyl)phenyl]prop-2-enoyl]amino]acetyl]-methylamino]-1-N,1-N,3-N,3-N-tetramethyl-2-[(2-methylquinolin-8-yl)oxymethyl]benzene-1,3-dicarboxamide
Molecular weight	678.79
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.2
Synonyms	BDBM50067927 4-({2-[(E)-3-(4-Dimethylcarbamoyl-phenyl)-acryloylamino]-acetyl}-methyl-amino)-N1,N1,N3,N3-tetramethyl-2-(2-methyl-quinolin-8-yloxymethyl)-isophthalamide; hydrochloride CHEMBL1193249
Inchi Key	HQDLMDUXNLTVKH-RCCKNPSSSA-N
Inchi ID	InChI=1S/C38H42N6O6/c1-24-12-16-26-10-9-11-31(35(26)40-24)50-23-29-28(37(48)42(4)5)19-20-30(34(29)38(49)43(6)7)44(8)33(46)22-39-32(45)21-15-25-13-17-27(18-14-25)36(47)41(2)3/h9-21H,22-23H2,1-8H3,(H,39,45)/b21-15+
PubChem CID	44360617
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50067927
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
121288	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391
121289	B2 bradykinin receptor	O70526	BDKRB2	Cavia porcellus (Guinea pig)	372

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