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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	CHEMBL333718
Molecular formula	C30H33N3O4
IUPAC name	tert-butyl 2-[(3R,5R)-3-[(3-methylphenyl)carbamoylamino]-2-oxo-5-phenyl-4,5-dihydro-3H-1-benzazepin-1-yl]acetate
Molecular weight	499.611
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	5.2
Synonyms	[[2,3,4,5-Tetrahydro-2-oxo-5alpha-phenyl-3alpha-[[[(3-methylphenyl)amino]carbonyl]amino]-1H-1-benzazepin]-1-yl]acetic acid tert-butyl ester BDBM50037870 [(3R,5R)-2-Oxo-5-phenyl-3-(3-m-tolyl-ureido)-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl]-acetic acid tert-butyl ester
Inchi Key	CLMCTKVZMVJCQP-JWQCQUIFSA-N
Inchi ID	InChI=1S/C30H33N3O4/c1-20-11-10-14-22(17-20)31-29(36)32-25-18-24(21-12-6-5-7-13-21)23-15-8-9-16-26(23)33(28(25)35)19-27(34)37-30(2,3)4/h5-17,24-25H,18-19H2,1-4H3,(H2,31,32,36)/t24-,25-/m1/s1
PubChem CID	10458620
ChEMBL	CHEMBL333718
IUPHAR	N/A
BindingDB	50037870
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
44851	Cholecystokinin receptor type A	Q63931	CCKAR	Cavia porcellus (Guinea pig)	430
44852	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447

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