[3H]fenobam   Click here for help

GtoPdb Ligand ID: 1433

PDB 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 6
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 73.8
Molecular weight 266.06
XLogP 1.77
No. Lipinski's rules broken 0
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Canonical SMILES O=C(NC1=NC(=O)CN1C)Nc1cccc(c1)Cl
Isomeric SMILES O=C(NC1=NC(=O)CN1C)Nc1cccc(c1)Cl
InChI InChI=1S/C11H11ClN4O2/c1-16-6-9(17)14-10(16)15-11(18)13-8-4-2-3-7(12)5-8/h2-5H,6H2,1H3,(H2,13,14,15,17,18)
Selectivity at GPCRs
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
mGlu5 receptor Hs Allosteric modulator Negative 7.5 pKd - 1
pKd 7.5 [1]
mGlu5 receptor Rn Allosteric modulator Negative 7.3 pKd - 1
pKd 7.3 [1]