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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	MLS000830374
Molecular formula	C24H26F3N3O3
IUPAC name	methyl (6S)-3-benzyl-2-(2-methoxyethylimino)-4-methyl-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate
Molecular weight	461.485
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.5
Synonyms	HMS2203E22 CHEMBL1335685 methyl (4S)-1-benzyl-2-(2-methoxyethylamino)-6-methyl-4-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate (4S)-1-benzyl-2-(2-methoxyethylamino)-6-methyl-4-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylic acid methyl ester SMR000672085 BDBM62142 cid_24789235 methyl (4S)-2-(2-methoxyethylamino)-6-methyl-1-(phenylmethyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylate (4S)-2-(2-methoxyethylamino)-6-methyl-1-(phenylmethyl)-4-[3-(trifluoromethyl)phenyl]-4H-pyrimidine-5-carboxylic acid methyl ester [ Show all ]
Inchi Key	AZIFWENGHFPMIR-NRFANRHFSA-N
Inchi ID	InChI=1S/C24H26F3N3O3/c1-16-20(22(31)33-3)21(18-10-7-11-19(14-18)24(25,26)27)29-23(28-12-13-32-2)30(16)15-17-8-5-4-6-9-17/h4-11,14,21H,12-13,15H2,1-3H3,(H,28,29)/t21-/m0/s1
PubChem CID	135693566
ChEMBL	CHEMBL1335685
IUPHAR	N/A
BindingDB	62142
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
18180	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
18179	Melanin-concentrating hormone receptor 1	Q99705	MCHR1	Homo sapiens (Human)	422
18178	Neuropeptides B/W receptor type 1	P48145	NPBWR1	Homo sapiens (Human)	328

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