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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	CHEMBL305403
Molecular formula	C28H31N7O3
IUPAC name	N-(2-aminoethyl)-4-[[4-[2-oxo-2-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)ethyl]piperazin-1-yl]methyl]benzamide
Molecular weight	513.602
Hydrogen bond acceptor	7
Hydrogen bond donor	3
XlogP	-0.1
Synonyms	BDBM50012363 N-(2-Amino-ethyl)-4-{4-[2-oxo-2-(6-oxo-5,6-dihydro-benzo[e]pyrido[3,2-b][1,4]diazepin-11-yl)-ethyl]-piperazin-1-ylmethyl}-benzamide 5,11-Dihydro-11-[[4-[4-(2-aminoethylaminocarbonyl)benzyl]-1-piperazinyl]acetyl]-6H-pyrido[2,3-b][1,4]benzodiazepin-6-one
Inchi Key	BMFWWGQJIXNFNW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H31N7O3/c29-11-13-31-27(37)21-9-7-20(8-10-21)18-33-14-16-34(17-15-33)19-25(36)35-24-6-2-1-4-22(24)28(38)32-23-5-3-12-30-26(23)35/h1-10,12H,11,13-19,29H2,(H,31,37)(H,32,38)
PubChem CID	15050948
ChEMBL	CHEMBL305403
IUPHAR	N/A
BindingDB	50012363
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
27435	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
27437	Muscarinic acetylcholine receptor M2	P10980	Chrm2	Rattus norvegicus (Rat)	466
27434	Muscarinic acetylcholine receptor M3	P08483	Chrm3	Rattus norvegicus (Rat)	589
27436	Muscarinic acetylcholine receptor M4	P08485	Chrm4	Rattus norvegicus (Rat)	478

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