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

CHEMBL1182226

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+](C)(CC)CCOc1ccc(C(=O)N2C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)C2)cc1

Basic Information

ChEMBL ID CHEMBL1182226
Phase Preclinical
Structure Type MOL
InChI Key NACOUJVLMZQCEM-KUKFKUQFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

599.7
MW (Da)
5.56
ALogP
7
HBA
0
HBD
132.9
PSA (Ų)
0.12
QED
2
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H35N4O7+
MW 599.66
Aromatic Rings 3
Heavy Atoms 44
NP-Likeness -0.58

Data from ChEMBL 36 via Core Engine