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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	AC1MFBCD
Molecular formula	C20H17Cl2N3O4S
IUPAC name	methyl 4-[3-[N-(2,5-dichlorophenyl)-N'-methylcarbamimidoyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate
Molecular weight	466.333
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.9
Synonyms	HMS2291H07 AKOS001746958 methyl 4-(3-{[[(2,5-dichlorophenyl)imino](methylamino)methyl]sulfanyl}-2,5-dioxo-1-pyrrolidinyl)benzoate MolPort-002-168-315 A2029/0085203 MCULE-8775992576 AKOS022016869 methyl 4-[3-[N-(2,5-dichlorophenyl)-N'-methylcarbamimidoyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate STK760461 CHEMBL1359792 methyl 4-(3-{[N'-(2,5-dichlorophenyl)-N-methylcarbamimidoyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoate MLS002540066 CHEBI:105193 [ Show all ]
Inchi Key	AFXPYHKXSBBVDU-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H17Cl2N3O4S/c1-23-20(24-15-9-12(21)5-8-14(15)22)30-16-10-17(26)25(18(16)27)13-6-3-11(4-7-13)19(28)29-2/h3-9,16H,10H2,1-2H3,(H,23,24)
PubChem CID	2869028
ChEMBL	CHEMBL1359792
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
4597	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
4596	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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