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

CHEMBL4060228

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
CCCN(CCC)CC(=O)Nc1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4060228
Phase Preclinical
Structure Type MOL
InChI Key FSEJIPKYGNGKON-PDGQHHTCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

412.5
MW (Da)
4.32
ALogP
3
HBA
3
HBD
77.2
PSA (Ų)
0.57
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H29FN4O2
MW 412.51
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -1.21

Literature References

PubMed DOI Target Context # Activities
28038328 10.1016/j.ejmech.2016.12.038 MV4-11 1

Data from ChEMBL 36 via Core Engine