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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	AF-353
Molecular formula	C14H17IN4O2
IUPAC name	5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine
Molecular weight	400.22
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	2.8
Synonyms	2,4-Pyrimidinediamine, 5-[5-iodo-4-methoxy-2-(1-methylethyl)phenoxy]- AKOS026750345 DTXSID90580447 NCGC00484064-01 5-(5-iodo-2-isopropyl-4-methoxy-phenoxy)-pyrimidine-2,4-diamine A841708 HY-14483 5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine. CTK2I3362 MolPort-020-001-886 5-(5-iodanyl-4-methoxy-2-propan-2-yl-phenoxy)pyrimidine-2,4-diamine 865305-30-2 BCP28391 EX-A1635 SCHEMBL1494138 5-(5-IODO-2-ISOPROPYL-4-METHOXYPHENOXY)PYRIMIDINE-2,4-DIAMINE AATPYXMXFBBKFO-UHFFFAOYSA-N CHEMBL526307 KB-3355831 5-[5-Iodo-4-methoxy-2-(propan-2-yl)phenoxy]pyrimidine-2,4-diamine AF353 D0B1KT MolPort-046-033-493 5-(5-iodo-2-isopropyl-4-methoxy-phenoxy) -pyrimidine-2,4-diamine A-375 BDBM50257636 GTPL4125 ZINC34809174 5-(5-iodo-4-methoxy-2-propan-2-ylphenoxy)pyrimidine-2,4-diamine AF 353 CS-5061 KB-74527 [ Show all ]
Inchi Key	AATPYXMXFBBKFO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H17IN4O2/c1-7(2)8-4-11(20-3)9(15)5-10(8)21-12-6-18-14(17)19-13(12)16/h4-7H,1-3H3,(H4,16,17,18,19)
PubChem CID	15953802
ChEMBL	CHEMBL526307
IUPHAR	N/A
BindingDB	50257636
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
531	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
529	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440
530	Histamine H2 receptor	P25021	HRH2	Homo sapiens (Human)	359

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