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

CHEMBL3401164

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
CCCCCCCCCCCCCCCO[P@]1(=O)CC[C@@H]2COC(=O)C2=C(C)O1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3401164
Phase Preclinical
Structure Type MOL
InChI Key ZPRBDRVNNUTXRC-ONOMSOESSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

428.6
MW (Da)
7.15
ALogP
5
HBA
0
HBD
61.8
PSA (Ų)
0.16
QED
1
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H41O5P
MW 428.55
Aromatic Rings 0
Heavy Atoms 29
NP-Likeness 0.45

Activity Summary

IC50 1 meas. best 6.35

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hormone-sensitive lipase
CHEMBL5582
 IC50 6.35 6.35 450.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Hormone-sensitive lipase IC50 = 450.0 nM 6.35 Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [... 25678014

Literature References

PubMed DOI Target Context # Activities
25678014 10.1016/j.bmc.2015.01.028 Hormone-sensitive lipase 1

Data from ChEMBL 36 via Core Engine