GSK1482160   Click here for help

GtoPdb Ligand ID: 10504

Synonyms: compound 1b [PMID: 31525963] | compound 31 [PMID: 20673717] | GSK-1482160
Immunopharmacology Ligand
Compound class: Synthetic organic
Comment: GSK1482160 is a P2X7 receptor antagonist [1]. It is active in in vivo animal models of pain.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 5
Topological polar surface area 49.41
Molecular weight 334.07
XLogP 2.36
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES CN1C(=O)CCC1C(=O)NCc1cccc(c1Cl)C(F)(F)F
Isomeric SMILES CN1C(=O)CC[C@H]1C(=O)NCc1cccc(c1Cl)C(F)(F)F
InChI InChI=1S/C14H14ClF3N2O2/c1-20-10(5-6-11(20)21)13(22)19-7-8-3-2-4-9(12(8)15)14(16,17)18/h2-4,10H,5-7H2,1H3,(H,19,22)/t10-/m0/s1
InChI Key BJEMSIVBBUBXMZ-JTQLQIEISA-N
Classification Click here for help
Compound class Synthetic organic
Synonyms Click here for help
compound 1b [PMID: 31525963] | compound 31 [PMID: 20673717] | GSK-1482160
Database Links Click here for help
BindingDB Ligand 50416603
CAS Registry No. 1001389-72-5 (source: PubChem)
ChEMBL Ligand CHEMBL1222883
GtoPdb PubChem SID 387065586
PubChem CID 23649427
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