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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	CHEMBL1087911
Molecular formula	C24H33N5O
IUPAC name	6-[cyclohexyl(cyclopropylmethyl)amino]-N-[4-[(dimethylamino)methyl]phenyl]pyrimidine-4-carboxamide
Molecular weight	407.562
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	4.2
Synonyms	ATFKFGZTHOJXBN-UHFFFAOYSA-N 6-(cyclohexyl(cyclopropylmethyl)amino)-N-(4-((dimethylamino)methyl)phenyl)pyrimidine-4-carboxamide BDBM50313345 SCHEMBL3024385 6-[cyclohexyl(cyclopropylmethyl)amino]-N-{4-[(dimethylamino)methyl]phenyl}pyrimidine-4-carboxamide
Inchi Key	ATFKFGZTHOJXBN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H33N5O/c1-28(2)15-18-10-12-20(13-11-18)27-24(30)22-14-23(26-17-25-22)29(16-19-8-9-19)21-6-4-3-5-7-21/h10-14,17,19,21H,3-9,15-16H2,1-2H3,(H,27,30)
PubChem CID	25182921
ChEMBL	CHEMBL1087911
IUPHAR	N/A
BindingDB	50313345
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
13911	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
459345	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378

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