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Compound Detail

CHEMBL279676

TENOCYCLIDINE
🧪 Phase II
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🧪 Phase II
c1csc(C2(N3CCCCC3)CCCCC2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL279676
Name TENOCYCLIDINE
Phase Phase II
Structure Type MOL
InChI Key JUZZEWSCNBCFRL-UHFFFAOYSA-N

Known Names

2-thienyl analog of phencyclidine Tenociclidina Tenocyclidine Thienylcyclidine Thienylcyclohexylpiperidine Thienylphencyclidine Thiophene analog of phencyclidine
5
Targets
8
Activities
1
Assay Types
0
PK Parameters
6
Publications
7
Known Names

Molecular Properties

249.4
MW (Da)
4.39
ALogP
2
HBA
0
HBD
3.2
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -clidine

Extended Properties

Molecular Formula C15H23NS
MW 249.42
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.68

Activity Summary

IC50 8 meas. best 7.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Lysosomal Pro-X carboxypeptidase
CHEMBL2335
 IC50 7.7 7.7 20.0 1
Unchecked
CHEMBL612545
 IC50 7.09 6.475 82.0 2
Acetylcholine receptor subunit alpha
CHEMBL3097
 IC50 6.62 6.18 237.0 2
Sigma non-opioid intracellular receptor 1
CHEMBL3602
 IC50 6.62 6.62 240.0 1
Sigma non-opioid intracellular receptor 1
CHEMBL287
 IC50 5.96 5.825 1100.0 2

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Lysosomal Pro-X carboxypeptidase IC50 = 20.0 nM 7.7 Inhibition of [3H]1-[1-(2-thienyl) piperidine ([3H]TCP) binding to phencyclidine... 2542555
Unchecked IC50 = 82.0 nM 7.09 Displacement of [3H]PCP from nAChR in Apis mellifera (honeybee0 head homogenates -
Sigma non-opioid intracellular receptor 1 IC50 = 240.0 nM 6.62 Inhibition of [3H]- N-allylnormetazocine ([3H]NANM) binding to sigma receptor 2542555
Acetylcholine receptor subunit alpha IC50 = 237.0 nM 6.62 Displacement of [3H]PCP from nAChR in Torpedo nobiliana electric organs membrane... -
Sigma non-opioid intracellular receptor 1 IC50 = 1100.0 nM 5.96 Inhibition of specific binding of [3H]NANM of sigma receptor in Guinea pig brain... 1469697
Unchecked IC50 = 1380.0 nM 5.86 Displacement of [3H]alpha-BGT from nAChR in Apis mellifera (honeybee) head homog... -
Acetylcholine receptor subunit alpha IC50 = 1830.0 nM 5.74 Displacement of [3H]PCP from nAChR in Torpedo nobiliana electric organs membrane... -
Sigma non-opioid intracellular receptor 1 IC50 = 2060.0 nM 5.69 Inhibition of specific binding of [125I]PIPAG to sigma receptor in Guinea pig br... 1469697

Literature References

PubMed DOI Target Context # Activities
- 10.1584/jpestics.20.49 Acetylcholine receptor subunit alpha 4
1469697 10.1021/jm00103a005 Sigma non-opioid intracellular receptor 1 2
- 10.1584/jpestics.20.57 Musca domestica 2
- 10.1584/jpestics.20.57 Unchecked 2
2542555 10.1021/jm00126a016 Lysosomal Pro-X carboxypeptidase 1
2542555 10.1021/jm00126a016 Sigma non-opioid intracellular receptor 1 1

Data from ChEMBL 36 via Core Engine