compound C10 [PMID: 24297249]   Click here for help

GtoPdb Ligand ID: 9162

Compound class: Synthetic organic
Comment: Partially selective GC-B (NPR-B) antagonist that mediates a strong reduction of the maximum cGMP production and no changes of the EC50 values for CNP
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 15.27
Molecular weight 286.12
XLogP 3.37
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES Clc1ccc(cc1)C(c1ccccc1)N1CCNCC1
Isomeric SMILES Clc1ccc(cc1)C(c1ccccc1)N1CCNCC1
InChI InChI=1S/C17H19ClN2/c18-16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)20-12-10-19-11-13-20/h1-9,17,19H,10-13H2
InChI Key UZKBSZSTDQSMDR-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
1-[(4-chlorophenyl)-phenylmethyl]piperazine
Database Links Click here for help
GtoPdb PubChem SID 315661245
PubChem CID 9340
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