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

CHEMBL4595106

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
C[n+]1ccc(/C=N/NC(=O)c2cccc(C(=O)N/N=C/c3cc[n+](C)c4ccccc34)n2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595106
Phase Preclinical
Structure Type MOL
InChI Key CVURQMOLKNHXLB-UHFFFAOYSA-P
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

503.6
MW (Da)
2.56
ALogP
5
HBA
2
HBD
103.6
PSA (Ų)
0.21
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H25N7O2+2
MW 503.57
Aromatic Rings 5
Heavy Atoms 38
NP-Likeness -0.64

Data from ChEMBL 36 via Core Engine