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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	SMR000102164
Molecular formula	C15H17FN4
IUPAC name	2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidine
Molecular weight	272.327
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	2.1
Synonyms	2-[4-[(3-fluorophenyl)methyl]-1-piperazinyl]pyrimidine BDBM38726 MLS000105283 ZINC19536766 AC1LG0ZS HMS2395N03 SR-01000201904-3 2-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]pyrimidine Cambridge id 5262831 MolPort-002-141-014 414880-94-7 CHEMBL1531923 SR-01000201904 2-[4-(3-fluorobenzyl)piperazino]pyrimidine AKOS003971138 MCULE-8057217717 Z46210756 2-{4-[(3-fluorophenyl)methyl]piperazin-1-yl}pyrimidine CHEBI:116368 Oprea1_287217 AB00077583-01 cid_763417 SR-01000201904-1 [ Show all ]
Inchi Key	DDFZWZOMOJAGID-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H17FN4/c16-14-4-1-3-13(11-14)12-19-7-9-20(10-8-19)15-17-5-2-6-18-15/h1-6,11H,7-10,12H2
PubChem CID	763417
ChEMBL	CHEMBL1531923
IUPHAR	N/A
BindingDB	38726
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
57066	5-hydroxytryptamine receptor 2A	P35363	Htr2a	Mus musculus (Mouse)	471
469975	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
57065	Mu-type opioid receptor	P35372	OPRM1	Homo sapiens (Human)	400

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