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

CHEMBL18596

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
COC[C@H]1OC(=O)C(=C(C)C)C2=C(O)C(=O)C3=C([C@H](OC(C)=O)C[C@]4(C)C(=O)CC[C@@H]34)[C@]21C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL18596
Phase Preclinical
Structure Type MOL
InChI Key YPVJDOMCFSUSDL-PEZPBUHZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

458.5
MW (Da)
2.91
ALogP
8
HBA
1
HBD
116.2
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H30O8
MW 458.51
Aromatic Rings 0
Heavy Atoms 33
NP-Likeness 2.27

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00191-U Unchecked 1

Data from ChEMBL 36 via Core Engine