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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	CHEMBL3680187
Molecular formula	C32H32ClFN4O3
IUPAC name	(4-fluorophenyl) N-[(3R,4S)-4-(4-chlorophenyl)-1-[1-(4-cyanophenyl)piperidine-4-carbonyl]-3-methylpyrrolidin-3-yl]-N-methylcarbamate
Molecular weight	575.081
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	5.7
Synonyms	BDBM109720 SCHEMBL10277547 US8618303, 10
Inchi Key	ASCLKPXIARRCAB-PPTMTGTBSA-N
Inchi ID	InChI=1S/C32H32ClFN4O3/c1-32(36(2)31(40)41-28-13-9-26(34)10-14-28)21-38(20-29(32)23-5-7-25(33)8-6-23)30(39)24-15-17-37(18-16-24)27-11-3-22(19-35)4-12-27/h3-14,24,29H,15-18,20-21H2,1-2H3/t29-,32+/m1/s1
PubChem CID	57414487
ChEMBL	CHEMBL3680187
IUPHAR	N/A
BindingDB	109720
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

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
13001	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465

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