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

CHEMBL4302823

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
N=C(N)c1ccc(NCCOCCNc2ccc(C(=N)N)cc2[N+](=O)[O-])c([N+](=O)[O-])c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4302823
Phase Preclinical
Structure Type MOL
InChI Key JPZRUGMREYZSPK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

430.4
MW (Da)
1.61
ALogP
9
HBA
6
HBD
219.3
PSA (Ų)
0.09
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H22N8O5
MW 430.43
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.96

Data from ChEMBL 36 via Core Engine