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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	CHEMBL49608
Molecular formula	C32H46N4O3
IUPAC name	1-butyl-1-[[3-[4-[[(2S,5S)-4-hexyl-1,5-dimethyl-3,6-dioxopiperazin-2-yl]methyl]phenyl]phenyl]methyl]-3-methylurea
Molecular weight	534.745
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	5.8
Synonyms	1-Butyl-1-[4''-((2S,5S)-4-hexyl-1,5-dimethyl-3,6-dioxo-piperazin-2-ylmethyl)-biphenyl-3-ylmethyl]-3-methyl-urea BDBM50142675
Inchi Key	LTPNZUAMKQUIHB-OUTSHDOLSA-N
Inchi ID	InChI=1S/C32H46N4O3/c1-6-8-10-11-20-36-24(3)30(37)34(5)29(31(36)38)22-25-15-17-27(18-16-25)28-14-12-13-26(21-28)23-35(19-9-7-2)32(39)33-4/h12-18,21,24,29H,6-11,19-20,22-23H2,1-5H3,(H,33,39)/t24-,29-/m0/s1
PubChem CID	44293189
ChEMBL	CHEMBL49608
IUPHAR	N/A
BindingDB	50142675
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
196108	Follicle-stimulating hormone receptor	P23945	FSHR	Homo sapiens (Human)	695

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