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Compound Detail

CHEMBL277382

PRODIPINE
🧪 Phase II
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🧪 Phase II
CC(C)N1CCC(c2ccccc2)(c2ccccc2)CC1

Basic Information

ChEMBL ID CHEMBL277382
Name PRODIPINE
Phase Phase II
Structure Type MOL
InChI Key CFOOTBBXHJHHMT-UHFFFAOYSA-N

Known Names

Prodipine Prodipino
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
2
Known Names

Molecular Properties

279.4
MW (Da)
4.48
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral
USAN Stem -dipine; -pine

Extended Properties

Molecular Formula C20H25N
MW 279.43
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.36

Activity Summary

Ki 1 meas. best 8.32

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Cytochrome P450 2D6
CHEMBL289
Ki 8.32 8.32 4.8 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Cytochrome P450 2D6 Ki = 4.8 nM 8.32 Inhibitory constant for cytochrome P450 2D6 8487254

Literature References

PubMed DOI Target Context # Activities
8487254 10.1021/jm00061a004 Cytochrome P450 2D6 1

Data from ChEMBL 36 via Core Engine