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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	MLS000040640
Molecular formula	C18H25N5O2
IUPAC name	ethyl 4-(cyclohexylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate
Molecular weight	343.431
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.2
Synonyms	MCULE-5156124346 909861-07-0 ethyl 4-(cyclohexylamino)-2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidine-5-carboxylate REGID_for_CID_662276 BDBM36917 KSC-6-231 STL338994 4-(cyclohexylamino)-2-(3,5-dimethyl-1-pyrazolyl)-5-pyrimidinecarboxylic acid ethyl ester CHEMBL1422386 AC1LD72C ethyl 4-(cyclohexylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylate SCHEMBL4217315 CHEBI:109564 KUC105637N ZINC8762731 4-(cyclohexylamino)-2-(3,5-dimethylpyrazol-1-yl)pyrimidine-5-carboxylic acid ethyl ester cid_662276 MolPort-002-596-622 AKOS022108431 HMS2386O13 SMR000042884 [ Show all ]
Inchi Key	CHDHJASAMSWOTG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H25N5O2/c1-4-25-17(24)15-11-19-18(23-13(3)10-12(2)22-23)21-16(15)20-14-8-6-5-7-9-14/h10-11,14H,4-9H2,1-3H3,(H,19,20,21)
PubChem CID	662276
ChEMBL	CHEMBL1422386
IUPHAR	N/A
BindingDB	36917
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
41874	Galanin receptor type 3	O60755	GALR3	Homo sapiens (Human)	368
41871	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
459589	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400
41875	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
41872	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
41873	Sphingosine 1-phosphate receptor 2	O95136	S1PR2	Homo sapiens (Human)	353

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