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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	CHEMBL391915
Molecular formula	C30H39Cl2FN4O2
IUPAC name	1-[(2R)-3-(2,4-dichlorophenyl)-1-[4-[2-[(1S)-1-(ethylamino)-3-methylbutyl]-6-fluorophenyl]piperazin-1-yl]-1-oxopropan-2-yl]pyrrolidin-2-one
Molecular weight	577.566
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	5.7
Synonyms	1-((R)-3-(2,4-dichlorophenyl)-1-(4-(2-((S)-1-(ethylamino)-3-methylbutyl)-6-fluorophenyl)piperazin-1-yl)-1-oxopropan-2-yl)pyrrolidin-2-one BDBM50221142
Inchi Key	AGENZPFZMBQUPS-RRPNLBNLSA-N
Inchi ID	InChI=1S/C30H39Cl2FN4O2/c1-4-34-26(17-20(2)3)23-7-5-8-25(33)29(23)35-13-15-36(16-14-35)30(39)27(37-12-6-9-28(37)38)18-21-10-11-22(31)19-24(21)32/h5,7-8,10-11,19-20,26-27,34H,4,6,9,12-18H2,1-3H3/t26-,27+/m0/s1
PubChem CID	44433265
ChEMBL	CHEMBL391915
IUPHAR	N/A
BindingDB	50221142
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
4806	Melanocortin receptor 4	P32245	MC4R	Homo sapiens (Human)	332

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