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

CHEMBL3303970

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
CC(C)/N=C(\N)Nc1ccc(NC(=O)c2ccc(N/C(N)=N/C(C)C)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3303970
Phase Preclinical
Structure Type MOL
InChI Key JQGFUUWUJADAJT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

395.5
MW (Da)
3.21
ALogP
3
HBA
5
HBD
129.9
PSA (Ų)
0.38
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H29N7O
MW 395.51
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.63

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C5MD00292C Unchecked 1

Data from ChEMBL 36 via Core Engine