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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	CHEMBL44686
Molecular formula	C29H34N2O3
IUPAC name	[(1R)-2-methyl-1-phenylpropyl] N-[(2R)-2-methyl-1-oxo-3-phenyl-1-[[(1S)-1-phenylethyl]amino]propan-2-yl]carbamate
Molecular weight	458.602
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	6.2
Synonyms	BDBM50050654 [(R)-1-Methyl-2-phenyl-1-((S)-1-phenyl-ethylcarbamoyl)-ethyl]-carbamic acid (R)-2-methyl-1-phenyl-propyl ester
Inchi Key	BDGXZMAYXTZKCG-GZWANVBQSA-N
Inchi ID	InChI=1S/C29H34N2O3/c1-21(2)26(25-18-12-7-13-19-25)34-28(33)31-29(4,20-23-14-8-5-9-15-23)27(32)30-22(3)24-16-10-6-11-17-24/h5-19,21-22,26H,20H2,1-4H3,(H,30,32)(H,31,33)/t22-,26+,29+/m0/s1
PubChem CID	10504093
ChEMBL	CHEMBL44686
IUPHAR	N/A
BindingDB	50050654
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	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
20918	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465

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