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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	CHEMBL387331
Molecular formula	C21H20F2N2O4
IUPAC name	methyl 2-[4-[[(1-acetamidocyclopropanecarbonyl)amino]methyl]-3-fluorophenyl]-6-fluorobenzoate
Molecular weight	402.398
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	2.4
Synonyms	BDBM50202415 methyl 4''-[({[1-(acetylamino)cyclopropyl]carbonyl}amino)-methyl]-3,3''-difluoro-1,1''-biphenyl-2-carboxylate
Inchi Key	AFLACRRVENIZQO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H20F2N2O4/c1-12(26)25-21(8-9-21)20(28)24-11-14-7-6-13(10-17(14)23)15-4-3-5-16(22)18(15)19(27)29-2/h3-7,10H,8-9,11H2,1-2H3,(H,24,28)(H,25,26)
PubChem CID	16102908
ChEMBL	CHEMBL387331
IUPHAR	N/A
BindingDB	50202415
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
4254	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353
4253	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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