SCH221510   Click here for help

GtoPdb Ligand ID: 8868

Synonyms: SCH 221510 | SCH-221510
Compound class: Synthetic organic
Comment: SCH221510 is a novel piperidine type, orally active nociceptin opioid (NOP) receptor agonist [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 1
Rotatable bonds 4
Topological polar surface area 23.47
Molecular weight 397.24
XLogP 6.1
No. Lipinski's rules broken 1
SMILES / InChI / InChIKey
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Canonical SMILES Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1
Isomeric SMILES Cc1ccccc1C(c1ccccc1C)N1C2CCC1CC(C2)(O)c1ccccc1
InChI InChI=1S/C28H31NO/c1-20-10-6-8-14-25(20)27(26-15-9-7-11-21(26)2)29-23-16-17-24(29)19-28(30,18-23)22-12-4-3-5-13-22/h3-15,23-24,27,30H,16-19H2,1-2H3
InChI Key LOSJNRBXNQTUNT-UHFFFAOYSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
8-[bis(2-methylphenyl)methyl]-3-phenyl-8-azabicyclo[3.2.1]octan-3-ol
Synonyms Click here for help
SCH 221510 | SCH-221510
Database Links Click here for help
CAS Registry No. 322473-89-2 (source: PubChem)
ChEMBL Ligand CHEMBL513136
GtoPdb PubChem SID 252827525
PubChem CID 9887077
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Tocris
SCH 221510
Cat. No. 3240