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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	CHEMBL342195
Molecular formula	C32H32N4O4
IUPAC name	4-[(E)-3-[[2-[N,2-dimethyl-3-[(2-methylquinolin-8-yl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide
Molecular weight	536.632
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	4.5
Synonyms	N-Methyl-4-{(E)-2-[({methyl-[2-methyl-3-(2-methyl-quinolin-8-yloxymethyl)-phenyl]-carbamoyl}-methyl)-carbamoyl]-vinyl}-benzamide SCHEMBL8366313 BDBM50067931
Inchi Key	AFNPYEOPZAKLQY-NBVRZTHBSA-N
Inchi ID	InChI=1S/C32H32N4O4/c1-21-11-15-24-7-6-10-28(31(24)35-21)40-20-26-8-5-9-27(22(26)2)36(4)30(38)19-34-29(37)18-14-23-12-16-25(17-13-23)32(39)33-3/h5-18H,19-20H2,1-4H3,(H,33,39)(H,34,37)/b18-14+
PubChem CID	10744917
ChEMBL	CHEMBL342195
IUPHAR	N/A
BindingDB	50067931
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
4299	B2 bradykinin receptor	O70526	BDKRB2	Cavia porcellus (Guinea pig)	372
4300	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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