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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	AC1MQQCV
Molecular formula	C21H23N5O6S
IUPAC name	N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide
Molecular weight	473.504
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	1.9
Synonyms	MCULE-7945339116 ZINC12539572 N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(7-nitro-4-oxo-3,4-dihydroquinazolin-3-yl)acetamide CHEMBL1562557 SMR000369701 MLS000760435 AKOS033475157 N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(7-nitro-4-oxoquinazolin-3-yl)acetamide HMS2709B04 Z16226667 784196-60-7 MolPort-004-276-077 SCHEMBL2999223 [ Show all ]
Inchi Key	AJSHSVUJADXRFD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H23N5O6S/c1-4-25(5-2)33(31,32)16-8-6-14(3)18(11-16)23-20(27)12-24-13-22-19-10-15(26(29)30)7-9-17(19)21(24)28/h6-11,13H,4-5,12H2,1-3H3,(H,23,27)
PubChem CID	3505859
ChEMBL	CHEMBL1562557
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
463769	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593
7191	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
7193	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
7192	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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