CCG-50014   Click here for help

GtoPdb Ligand ID: 7784

Synonyms: CCG 50014 | CCG50014 | compound 1a [4]
Compound class: Synthetic organic
Comment: CCG-50014 is a potent small molecule inhibitor of regulator of G-protein signaling protein 4 (RGS4) [1].
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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 3
Topological polar surface area 71.72
Molecular weight 316.07
XLogP 3.4
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Cc1ccc(cc1)n1sc(=O)n(c1=O)Cc1ccc(cc1)F
Isomeric SMILES Cc1ccc(cc1)n1sc(=O)n(c1=O)Cc1ccc(cc1)F
InChI InChI=1S/C16H13FN2O2S/c1-11-2-8-14(9-3-11)19-15(20)18(16(21)22-19)10-12-4-6-13(17)7-5-12/h2-9H,10H2,1H3
InChI Key QUIIIYITNGOFEI-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
4-[(4-fluorophenyl)methyl]-2-(4-methylphenyl)-1,2,4-thiadiazolidine-3,5-dione
Synonyms Click here for help
CCG 50014 | CCG50014 | compound 1a [4]
Database Links Click here for help
CAS Registry No. 883050-24-6
ChEMBL Ligand CHEMBL1917204
GtoPdb PubChem SID 249565573
PubChem CID 2733079
Search Google for chemical match using the InChIKey QUIIIYITNGOFEI-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QUIIIYITNGOFEI
UniChem Compound Search for chemical match using the InChIKey QUIIIYITNGOFEI-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey QUIIIYITNGOFEI-UHFFFAOYSA-N

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Tocris
CCG 50014 (links to external site)
Cat. No. 4567