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

CHEMBL4597370

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
COc1cc(OC)cc(C(=O)Nc2nc(-c3ccccc3)c(CCCN3CCN(C)CC3)s2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4597370
Phase Preclinical
Structure Type MOL
InChI Key DMRMHEZQZBDALQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.6
MW (Da)
4.26
ALogP
7
HBA
1
HBD
66.9
PSA (Ų)
0.49
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32N4O3S
MW 480.63
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.54

Data from ChEMBL 36 via Core Engine