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

CHEMBL502680

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
CC(C)CC(NC(=O)[C@@]1(C)CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL502680
Phase Preclinical
Structure Type MOL
InChI Key PWLRUJLKLDQEQC-CKUYLRCJSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

583.9
MW (Da)
6.94
ALogP
4
HBA
3
HBD
103.7
PSA (Ų)
0.33
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C36H57NO5
MW 583.85
Aromatic Rings 0
Heavy Atoms 42
NP-Likeness 2.42

Literature References

PubMed DOI Target Context # Activities
18562200 10.1016/j.bmc.2008.05.078 Unchecked 1

Data from ChEMBL 36 via Core Engine