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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	CHEMBL87079
Molecular formula	C31H35N5O2
IUPAC name	(2S)-3-(1H-indol-3-yl)-2-methyl-2-(phenylcarbamoylamino)-N-[(1-pyridin-2-ylcyclohexyl)methyl]propanamide
Molecular weight	509.654
Hydrogen bond acceptor	3
Hydrogen bond donor	4
XlogP	5.4
Synonyms	BDBM50071752 (S)-3-(1H-Indol-3-yl)-2-methyl-2-(3-phenyl-ureido)-N-(1-pyridin-2-yl-cyclohexylmethyl)-propionamide
Inchi Key	KBRYXXQXNXKGKB-PMERELPUSA-N
Inchi ID	InChI=1S/C31H35N5O2/c1-30(36-29(38)35-24-12-4-2-5-13-24,20-23-21-33-26-15-7-6-14-25(23)26)28(37)34-22-31(17-9-3-10-18-31)27-16-8-11-19-32-27/h2,4-8,11-16,19,21,33H,3,9-10,17-18,20,22H2,1H3,(H,34,37)(H2,35,36,38)/t30-/m0/s1
PubChem CID	44321085
ChEMBL	CHEMBL87079
IUPHAR	N/A
BindingDB	50071752
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
165318	Gastrin-releasing peptide receptor	P30550	GRPR	Homo sapiens (Human)	384
165319	Neuromedin-B receptor	P28336	NMBR	Homo sapiens (Human)	390

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