[11C]SB207145   Click here for help

GtoPdb Ligand ID: 3244

Synonyms: [11C] SB207145 (PET ligand)
 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
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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 4
Topological polar surface area 74.02
Molecular weight 337.1
XLogP 1.71
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES [C]N1CCC(CC1)COC(=O)c1cc(Cl)c(c2c1OCCO2)N
Isomeric SMILES [11C]N1CCC(CC1)COC(=O)c1cc(Cl)c(c2c1OCCO2)N
InChI InChI=1S/C16H18ClN2O4/c1-19-4-2-10(3-5-19)9-23-16(20)11-8-12(17)13(18)15-14(11)21-6-7-22-15/h8,10H,2-7,9,18H2/i1-1
InChI Key GZIVVHOGLMLPGS-BJUDXGSMSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(4-{[(8-amino-7-chloro-2,3-dihydro-1,4-benzodioxin-5-yl)carbonyloxy]methyl}piperidin-1-yl)([11C])methylidyne
Synonyms Click here for help
[11C] SB207145 (PET ligand)
Database Links Click here for help
GtoPdb PubChem SID 178100293
PubChem CID 73755034
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