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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	CHEMBL215894
Molecular formula	C37H41Cl3N4O4
IUPAC name	(2R)-1-[(2S,4R)-4-hydroxy-1-[3,3,3-tris(4-chlorophenyl)propanoyl]pyrrolidine-2-carbonyl]-N-[[(3R)-piperidin-3-yl]methyl]pyrrolidine-2-carboxamide
Molecular weight	712.109
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	5.9
Synonyms	BDBM50194643 SCHEMBL4579494 (2R)-1-((2S,4R)-4-hydroxy-1-[3,3,3-tris(4-chlorophenyl)propanoyl]pyrrolidine-2-yl)carbonyl-N-((3R)-3-piperidinylmethyl)-pyrrolidine-2-carboxamide
Inchi Key	AFAZXESEAHMGAC-BMSWWXRLSA-N
Inchi ID	InChI=1S/C37H41Cl3N4O4/c38-28-11-5-25(6-12-28)37(26-7-13-29(39)14-8-26,27-9-15-30(40)16-10-27)20-34(46)44-23-31(45)19-33(44)36(48)43-18-2-4-32(43)35(47)42-22-24-3-1-17-41-21-24/h5-16,24,31-33,41,45H,1-4,17-23H2,(H,42,47)/t24-,31-,32-,33+/m1/s1
PubChem CID	16086067
ChEMBL	CHEMBL215894
IUPHAR	N/A
BindingDB	50194643
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. 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
4009	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
4006	Muscarinic acetylcholine receptor M2	P08172	CHRM2	Homo sapiens (Human)	466
4007	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590
4010	Muscarinic acetylcholine receptor M4	P08173	CHRM4	Homo sapiens (Human)	479
4008	Muscarinic acetylcholine receptor M5	P08912	CHRM5	Homo sapiens (Human)	532

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