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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	CHEMBL70728
Molecular formula	C24H18ClN3O
IUPAC name	(3R)-7-chloro-3-(1H-indol-3-ylmethyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one
Molecular weight	399.878
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	5.0
Synonyms	BDBM50019202 CCK antagonist synthetic 5 SCHEMBL7514683 7-Chloro-3-(1H-indol-3-ylmethyl)-5-phenyl-1,3-dihydro-benzo[e][1,4]diazepin-2-one
Inchi Key	OAAIQFQHSUFGKD-JOCHJYFZSA-N
Inchi ID	InChI=1S/C24H18ClN3O/c25-17-10-11-21-19(13-17)23(15-6-2-1-3-7-15)27-22(24(29)28-21)12-16-14-26-20-9-5-4-8-18(16)20/h1-11,13-14,22,26H,12H2,(H,28,29)/t22-/m1/s1
PubChem CID	9865694
ChEMBL	CHEMBL70728
IUPHAR	N/A
BindingDB	50019202
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
236176	Cholecystokinin receptor type A	Q63931	CCKAR	Cavia porcellus (Guinea pig)	430
236177	Cholecystokinin receptor type A	O08786	Cckar	Mus musculus (Mouse)	436
236178	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447

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