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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	CHEMBL207000
Molecular formula	C28H26F2N4O3
IUPAC name	methyl 2-fluoro-6-[3-fluoro-4-[[[5-(4-prop-2-ynylpiperazine-1-carbonyl)pyridin-2-yl]amino]methyl]phenyl]benzoate
Molecular weight	504.538
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	3.7
Synonyms	3,3''-difluoro-4''-{[5-(4-prop-2-ynyl-piperazine-1-carbonyl)-pyridin-2-ylamino]-methyl}-biphenyl-2-carboxylic acid methyl ester BDBM50184170
Inchi Key	BIBKOTINIYREPN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H26F2N4O3/c1-3-11-33-12-14-34(15-13-33)27(35)21-9-10-25(32-18-21)31-17-20-8-7-19(16-24(20)30)22-5-4-6-23(29)26(22)28(36)37-2/h1,4-10,16,18H,11-15,17H2,2H3,(H,31,32)
PubChem CID	44411347
ChEMBL	CHEMBL207000
IUPHAR	N/A
BindingDB	50184170
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
24310	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353

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