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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	CHEMBL68709
Molecular formula	C25H23N5O3
IUPAC name	11-[2-(4-benzoylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Molecular weight	441.491
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	1.2
Synonyms	11-[2-(4-Benzoyl-piperazin-1-yl)-acetyl]-5,11-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-6-one BDBM50012329 5,11-Dihydro-11-[[4-benzoyl-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Inchi Key	CBJZAKJGURGLPY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H23N5O3/c31-22(17-28-13-15-29(16-14-28)25(33)18-7-2-1-3-8-18)30-21-11-5-4-9-19(21)24(32)27-20-10-6-12-26-23(20)30/h1-12H,13-17H2,(H,27,32)
PubChem CID	15050938
ChEMBL	CHEMBL68709
IUPHAR	N/A
BindingDB	50012329
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
37952	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
37954	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
37955	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589
37953	Muscarinic acetylcholine receptor M4	P08485	Chrm4	Rattus norvegicus (Rat)	478

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