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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	CHEMBL3918007
Molecular formula	C30H34Cl3N5O2S
IUPAC name	5-(4-chlorophenyl)-N-[[(3R,5R)-1-[(3,5-dichlorophenyl)methyl]-2-oxo-3-(2-piperidin-1-ylethyl)-1,4-diazepan-5-yl]methyl]-1,2-thiazole-3-carboxamide
Molecular weight	635.045
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	6.2
Synonyms	BDBM232178 US9340517, 566
Inchi Key	AKWJSGJUTIIQIT-CLJLJLNGSA-N
Inchi ID	InChI=1S/C30H34Cl3N5O2S/c31-22-6-4-21(5-7-22)28-17-27(36-41-28)29(39)34-18-25-8-13-38(19-20-14-23(32)16-24(33)15-20)30(40)26(35-25)9-12-37-10-2-1-3-11-37/h4-7,14-17,25-26,35H,1-3,8-13,18-19H2,(H,34,39)/t25-,26-/m1/s1
PubChem CID	127054363
ChEMBL	CHEMBL3918007
IUPHAR	N/A
BindingDB	232178
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
533940	Melanocortin receptor 5	P33032	MC5R	Homo sapiens (Human)	325

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