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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	AC1NWUEH
Molecular formula	C13H17Cl2N3OS
IUPAC name	3-tert-butyl-1-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylideneamino]-1-methylthiourea
Molecular weight	334.259
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.7
Synonyms	SCHEMBL5312426 IDI1_030607 N1-(tert-butyl)-2-(3,5-dichloro-2-hydroxybenzylidene)-1-methylhydrazine-1-carbothioamide CHEMBL3190200 SMR000455772 3-tert-butyl-1-[(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1-methylthiourea MLS000849754 AC1OAF57 REGID_for_CID_5712544 HMS1521B03 3-tert-butyl-1-[[(E)-(3,5-dichloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1-methylthiourea MolPort-002-890-468 [ Show all ]
Inchi Key	ADJHAOREQGPZCH-FRKPEAEDSA-N
Inchi ID	InChI=1S/C13H17Cl2N3OS/c1-13(2,3)17-12(20)18(4)16-7-8-5-9(14)6-10(15)11(8)19/h5-7,19H,1-4H3,(H,17,20)/b16-7+
PubChem CID	135445518
ChEMBL	CHEMBL3190200
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
557366	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
557365	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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