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

CHEMBL3220482

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
O=C(NCc1ccccc1)c1ccccc1Nc1ccnc(Nc2ccc(N3CCOCC3)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3220482
Phase Preclinical
Structure Type MOL
InChI Key FQTXSDVFEIZKQQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

479.6
MW (Da)
5.34
ALogP
6
HBA
3
HBD
78.5
PSA (Ų)
0.32
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H29N5O2
MW 479.58
Aromatic Rings 4
Heavy Atoms 36
NP-Likeness -1.55

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C1MD00219H Mitogen-activated protein kinase 9 1
- 10.1039/C1MD00219H Mitogen-activated protein kinase 10 1

Data from ChEMBL 36 via Core Engine