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

CHEMBL1482486

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
COc1ccc(NC(S)=NCCN2CCC(C)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1482486
Phase Preclinical
Structure Type MOL
InChI Key SGBRBNIUXHHEHT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

307.5
MW (Da)
3.12
ALogP
3
HBA
2
HBD
36.9
PSA (Ų)
0.50
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H25N3OS
MW 307.46
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -1.26

Literature References

PubMed DOI Target Context # Activities
28433681 10.1016/j.ejmech.2017.03.050 Acetylcholinesterase 3
28433681 10.1016/j.ejmech.2017.03.050 Unchecked 1

Data from ChEMBL 36 via Core Engine