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

CHEMBL5517774

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
COc1cc2c(cc1Nc1ncc3c(N)cc(=O)n(Cc4ccc(C(F)(F)F)cc4)c3n1)CN(C)CC2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5517774
Phase Preclinical
Structure Type MOL
InChI Key MMNIBNZOBGUTPS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

510.5
MW (Da)
4.18
ALogP
8
HBA
2
HBD
98.3
PSA (Ų)
0.42
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H25F3N6O2
MW 510.52
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -0.97

Literature References

PubMed DOI Target Context # Activities
38479166 10.1016/j.ejmech.2024.116310 Mitogen-activated protein kinase kinase kinase kinase 1 1

Data from ChEMBL 36 via Core Engine