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

CHEMBL3290503

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]([C@H](C)CC)O[C@H](/C=C/C=C/C(=O)O)[C@@H](O)[C@H]2[C@@H]3CC=C(C)C[C@H]3C=C(C)[C@@]12O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3290503
Phase Preclinical
Structure Type MOL
InChI Key RNNQLHOUBURQQV-LJTYFLQPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

428.6
MW (Da)
4.19
ALogP
4
HBA
3
HBD
87.0
PSA (Ų)
0.35
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C26H36O5
MW 428.57
Aromatic Rings 0
Heavy Atoms 31
NP-Likeness 2.94

Literature References

PubMed DOI Target Context # Activities
24926891 10.1021/np500143k Unchecked 2
24926891 10.1021/np500143k DNA polymerase beta 2
24926891 10.1021/np500143k HCT-116 1

Data from ChEMBL 36 via Core Engine