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

CHEMBL4225272

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
CN1CCN(C(=O)c2cccc(/C=c3\[nH]c(=O)/c(=C/c4nc[nH]c4C(C)(C)C)[nH]c3=O)c2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4225272
Phase Preclinical
Structure Type MOL
InChI Key HPZAVFUZOYFNOG-AXPXABNXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

462.6
MW (Da)
0.13
ALogP
5
HBA
3
HBD
118.0
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 C25H30N6O3
MW 462.55
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -0.33

Literature References

PubMed DOI Target Context # Activities
29571653 10.1016/j.bmc.2018.03.005 Tubulin 1
29571653 10.1016/j.bmc.2018.03.005 BXPC-3 1
29571653 10.1016/j.bmc.2018.03.005 No relevant target 1

Data from ChEMBL 36 via Core Engine