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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	CHEMBL390916
Molecular formula	C23H24Cl2N6O2
IUPAC name	4-chloro-3-[(2-chlorobenzoyl)amino]-N-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]-1H-pyrazole-5-carboxamide
Molecular weight	487.385
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	4.1
Synonyms	BDBM50222663 SCHEMBL6045885 4-chloro-5-[(2-chlorobenzoyl)amino]-N-[2-[1-(4-pyridinyl)-4-piperidinyl]ethyl]-1Hpyrazole-3-carboxamide
Inchi Key	AQYXKYFELDZAIQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H24Cl2N6O2/c24-18-4-2-1-3-17(18)22(32)28-21-19(25)20(29-30-21)23(33)27-12-5-15-8-13-31(14-9-15)16-6-10-26-11-7-16/h1-4,6-7,10-11,15H,5,8-9,12-14H2,(H,27,33)(H2,28,29,30,32)
PubChem CID	23630511
ChEMBL	CHEMBL390916
IUPHAR	N/A
BindingDB	50222663
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
12216	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353

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