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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	CHEMBL3983937
Molecular formula	C22H27N5OS
IUPAC name	4-methyl-5-[4-methyl-5-[3-[(2S,3R)-2-phenyl-5-azaspiro[2.4]heptan-5-yl]propylsulfanyl]-1,2,4-triazol-3-yl]-1,3-oxazole
Molecular weight	409.552
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	3.3
Synonyms	BDBM50192034 SCHEMBL17712767
Inchi Key	AAPXNHMQKBDDJN-PGRDOPGGSA-N
Inchi ID	InChI=1S/C22H27N5OS/c1-16-19(28-15-23-16)20-24-25-21(26(20)2)29-12-6-10-27-11-9-22(14-27)13-18(22)17-7-4-3-5-8-17/h3-5,7-8,15,18H,6,9-14H2,1-2H3/t18-,22+/m0/s1
PubChem CID	121304458
ChEMBL	CHEMBL3983937
IUPHAR	N/A
BindingDB	50192034
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
535918	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
535917	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
535916	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
535919	D(4) dopamine receptor	P21917	DRD4	Homo sapiens (Human)	467
535920	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
535921	Muscarinic acetylcholine receptor M3	P20309	CHRM3	Homo sapiens (Human)	590

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