Details of the Drug

General Information of Drug (ID: DMRM1QV)

Drug Name
Tenocyclidine
Synonyms
TENOCYCLIDINE; thienyl cyclohexylpiperidine; Tenocyclidinum; Tenociclidina; 1-(1-(2-Thienyl)cyclohexyl)piperidine; Tenocyclidine [INN]; 21500-98-1; UNII-8BQ45Q6VCL; Tenocyclidinum [INN-Latin]; 1-[1-(2-thienyl)cyclohexyl]piperidine; 8BQ45Q6VCL; Tenociclidina [INN-Spanish]; CHEMBL279676; Piperidine, 1-(1-(2-thienyl)cyclohexyl)-; DEA No. 7470; Thiophene analog of phencyclidine; CHEBI:64610; 2-Thienyl analog of phencyclidine; JUZZEWSCNBCFRL-UHFFFAOYSA-N; BRN 1246605; 1-(1-[2-Thienyl]cyclohexyl)piperidine; NCGC00160467-01
Indication
Disease Entry ICD 11 Status REF
Discovery agent N.A. Investigative [1]
Affected Organisms
Humans and other mammals
Drug Type
Small molecular drug
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 0 Molecular Weight (mw) 249.4
Logarithm of the Partition Coefficient (xlogp) 3.9
Rotatable Bond Count (rotbonds) 2
Hydrogen Bond Donor Count (hbonddonor) 0
Hydrogen Bond Acceptor Count (hbondacc) 2
Chemical Identifiers
Formula
C15H23NS
IUPAC Name
1-(1-thiophen-2-ylcyclohexyl)piperidine
Canonical SMILES
C1CCC(CC1)(C2=CC=CS2)N3CCCCC3
InChI
InChI=1S/C15H23NS/c1-3-9-15(10-4-1,14-8-7-13-17-14)16-11-5-2-6-12-16/h7-8,13H,1-6,9-12H2
InChIKey
JUZZEWSCNBCFRL-UHFFFAOYSA-N
Cross-matching ID
PubChem CID
62751
ChEBI ID
CHEMBL279676
CAS Number
21500-98-1
UNII
8BQ45Q6VCL
DrugBank ID
DB01520
TTD ID
D00VKV
Drug-Molecule Activity Atlas (DMA)NEW Click to Jump to the Detailed DMA Information of This Drug
Drug ADMET Endpoint Profile (DAE)NEW Click to Jump to the Detailed DAE Information of This Drug

Molecular Interaction Atlas of This Drug


Drug Therapeutic Target (DTT)
DTT Name DTT ID UniProt ID MOA REF
Glutamate receptor ionotropic NMDA 2A (NMDAR2A) TTKJEMQ NMDE1_HUMAN Antagonist [1]
Glutamate receptor ionotropic NMDA 2B (NMDAR2B) TTN9D8E NMDE2_HUMAN Antagonist [1]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

Molecular Expression Atlas of This Drug

The Studied Disease Discovery agent
ICD Disease Classification N.A.
Molecule Name Molecule Type Gene Name p-value Fold-Change Z-score
Glutamate receptor ionotropic NMDA 2B (NMDAR2B) DTT GRIN2B 7.51E-01 -0.06 -0.32
Glutamate receptor ionotropic NMDA 2A (NMDAR2A) DTT GRIN2A 8.43E-01 -0.37 -0.45
Molecular Expression Atlas (MEA) Jump to Detail Molecular Expression Atlas of This Drug

References

1 The binding of [3H]thienyl cyclohexylpiperidine ([3H]TCP) to the NMDA-phencyclidine receptor complex. Neuropharmacology. 1989 Jan;28(1):1-7.