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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	Spermidine tris-PheG
Molecular formula	C28H37N9
IUPAC name	1-[4-[[amino(anilino)methylidene]amino]butyl]-1-[3-[[amino(anilino)methylidene]amino]propyl]-2-phenylguanidine
Molecular weight	499.667
Hydrogen bond acceptor	3
Hydrogen bond donor	5
XlogP	2.9
Synonyms	BDBM50431876 Spermadine Phenylguanide 3-phenyl-1-[4-[(N-phenylcarbamimidoyl)amino]butyl]-1-[3-[(N-phenylcarbamimidoyl)amino]propyl]guanidine CHEMBL2347624 3-Phenyl-1-[4-(N'-phenylcarbamimidamido)butyl]-1-[3-(N'-phenylcarbamimidamido)propyl]guanidine (non-preferred name) Spermidine tris-Phenylguanide [ Show all ]
Inchi Key	ASLYPGQJJKJRQX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H37N9/c29-26(34-23-13-4-1-5-14-23)32-19-10-11-21-37(28(31)36-25-17-8-3-9-18-25)22-12-20-33-27(30)35-24-15-6-2-7-16-24/h1-9,13-18H,10-12,19-22H2,(H2,31,36)(H3,29,32,34)(H3,30,33,35)
PubChem CID	71589167
ChEMBL	CHEMBL2347624
IUPHAR	N/A
BindingDB	50431876
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
13274	C-X-C chemokine receptor type 4	P61073	CXCR4	Homo sapiens (Human)	352

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