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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	SMR000221562
Molecular formula	C18H23N3S
IUPAC name	N,N-dimethyl-3-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]propan-1-amine
Molecular weight	313.463
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.8
Synonyms	dimethyl-[3-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]propyl]amine AC1M0G9N CHEBI:115488 MLS000332122 cid_1998473 N,N-dimethyl-3-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]-1-propanamine HMS2599H13 STK588424 AKOS005510716 MolPort-002-607-403 Dimethyl-[3-(2-phenyl-6,7-dihydro-5H-cyclopentapyrimidin-4-ylsulfanyl)-propyl]-amine REGID_for_CID_1998473 844448-99-3 MCULE-5439410210 ZINC2400421 BDBM42533 CHEMBL1386511 N,N-dimethyl-3-[(2-phenyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]propan-1-amine [ Show all ]
Inchi Key	AZYBPQSWPOOMFP-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H23N3S/c1-21(2)12-7-13-22-18-15-10-6-11-16(15)19-17(20-18)14-8-4-3-5-9-14/h3-5,8-9H,6-7,10-13H2,1-2H3
PubChem CID	1998473
ChEMBL	CHEMBL1386511
IUPHAR	N/A
BindingDB	42533
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
18583	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
18585	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
18584	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381

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