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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	CHEMBL3128187
Molecular formula	C23H27N5O2
IUPAC name	(2S)-N-[4-[[(2S,5R)-5-[(R)-hydroxy(pyridin-3-yl)methyl]pyrrolidin-2-yl]methyl]phenyl]-2-pyrazol-1-ylpropanamide
Molecular weight	405.502
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	1.9
Synonyms	N/A
Inchi Key	BCNXERGQHXCNKJ-FBEWHJACSA-N
Inchi ID	InChI=1S/C23H27N5O2/c1-16(28-13-3-12-25-28)23(30)27-19-7-5-17(6-8-19)14-20-9-10-21(26-20)22(29)18-4-2-11-24-15-18/h2-8,11-13,15-16,20-22,26,29H,9-10,14H2,1H3,(H,27,30)/t16-,20-,21+,22+/m0/s1
PubChem CID	76314766
ChEMBL	CHEMBL3128187
IUPHAR	N/A
BindingDB	N/A
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
20353	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
20354	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
20352	Beta-3 adrenergic receptor	P13945	ADRB3	Homo sapiens (Human)	408

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