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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	CHEMBL519893
Molecular formula	C30H32N6O4
IUPAC name	4-[[(2S)-1-[[1-[(4-cyanophenyl)methyl]pyrrolidin-3-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]carbamoylamino]-N-methylbenzamide
Molecular weight	540.624
Hydrogen bond acceptor	6
Hydrogen bond donor	5
XlogP	2.6
Synonyms	BDBM50413123
Inchi Key	AMSLUDLIDFRROJ-GPNIZQGCSA-N
Inchi ID	InChI=1S/C30H32N6O4/c1-32-28(38)23-8-10-24(11-9-23)34-30(40)35-27(16-20-6-12-26(37)13-7-20)29(39)33-25-14-15-36(19-25)18-22-4-2-21(17-31)3-5-22/h2-13,25,27,37H,14-16,18-19H2,1H3,(H,32,38)(H,33,39)(H2,34,35,40)/t25?,27-/m0/s1
PubChem CID	44589499
ChEMBL	CHEMBL519893
IUPHAR	N/A
BindingDB	50413123
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
9202	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
9201	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
9203	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590

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