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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	AC1MCIX6
Molecular formula	C19H15ClN6O3S2
IUPAC name	1-(3-chlorophenyl)-3-[[5-methyl-4-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,2-oxazole-3-carbonyl]amino]urea
Molecular weight	474.938
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	3.7
Synonyms	N'-(3-chlorophenylcarbamoyl)-5-methyl-4-[2-(2-methyl-4-thiazolyl)-4-thiazolyl]isoxazole-3-carbohydrazide CHEMBL1524716 ZINC3119959 MLS000834943 CCG-53089 SMR000461459 HMS2795H12 1-(3-chlorophenyl)-3-[[5-methyl-4-[2-(2-methyl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]-1,2-oxazole-3-carbonyl]amino]urea MolPort-002-925-027 SR-01000642278-1 MCULE-3985898782 [ Show all ]
Inchi Key	BPEAWAGQVZSVPR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H15ClN6O3S2/c1-9-15(13-7-31-18(23-13)14-8-30-10(2)21-14)16(26-29-9)17(27)24-25-19(28)22-12-5-3-4-11(20)6-12/h3-8H,1-2H3,(H,24,27)(H2,22,25,28)
PubChem CID	2744894
ChEMBL	CHEMBL1524716
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
29467	5-hydroxytryptamine receptor 2A	P35363	Htr2a	Mus musculus (Mouse)	471
29466	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400

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