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

CHEMBL4597221

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[n+]1cccc2cc(/C=N/NC(=O)c3ccc4ccc(C(=O)N/N=C/c5ccc6c(ccc[n+]6CC)c5)nc4n3)ccc21

Basic Information

ChEMBL ID CHEMBL4597221
Phase Preclinical
Structure Type MOL
InChI Key NWXLVUPYJHAUJV-JTOYJDTJSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

582.7
MW (Da)
4.08
ALogP
6
HBA
2
HBD
116.5
PSA (Ų)
0.16
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H30N8O2+2
MW 582.67
Aromatic Rings 6
Heavy Atoms 44
NP-Likeness -0.65

Data from ChEMBL 36 via Core Engine