Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL158922

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
C=C1[C@@H](O)[C@@H]2O[C@]3(CCCO3)CC[C@H]2O[C@@H]1[C@@H](O)C[C@H](C)[C@H]1O[C@@]2(CCCCO2)CC[C@H]1C

Basic Information

ChEMBL ID CHEMBL158922
Phase Preclinical
Structure Type MOL
InChI Key ZTLXSOXMBQCJHM-YXEOJBFZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

466.6
MW (Da)
3.46
ALogP
7
HBA
2
HBD
86.6
PSA (Ų)
0.61
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H42O7
MW 466.62
Aromatic Rings 0
Heavy Atoms 33
NP-Likeness 1.70

Literature References

PubMed DOI Target Context # Activities
11266161 10.1016/s0960-894x(01)00026-9 Protein phosphatase 1B 1
11266161 10.1016/s0960-894x(01)00026-9 Serine/threonine-protein phosphatase 2A catalytic subunit alpha isoform 1

Data from ChEMBL 36 via Core Engine