SKF-86002   Click here for help

GtoPdb Ligand ID: 6040

Synonyms: SK&F 86002 | SKF 86002
PDB Ligand
Compound class: Synthetic organic
Comment: SKF-86002 is a potent inhibitor of p38 MAPK.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 56.01
Molecular weight 297.07
XLogP 3.87
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Fc1ccc(cc1)c1nc2n(c1c1ccncc1)CCS2
Isomeric SMILES Fc1ccc(cc1)c1nc2n(c1c1ccncc1)CCS2
InChI InChI=1S/C16H12FN3S/c17-13-3-1-11(2-4-13)14-15(12-5-7-18-8-6-12)20-9-10-21-16(20)19-14/h1-8H,9-10H2
InChI Key YOELZIQOLWZLQC-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
4-[6-(4-fluorophenyl)-2H,3H-imidazo[2,1-b][1,3]thiazol-5-yl]pyridine
Synonyms Click here for help
SK&F 86002 | SKF 86002
Database Links Click here for help
CAS Registry No. 72873-74-6
ChEMBL Ligand CHEMBL313417
GtoPdb PubChem SID 178102662
PubChem CID 5228
RCSB PDB Ligand SK8
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