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

CHEMBL111200

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
Cc1cccc(/C=C2/N=C(SCC(C)C)NC(=O)C2(C)C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL111200
Phase Preclinical
Structure Type MOL
InChI Key GGKGPJUREZZKBS-XNTDXEJSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

316.5
MW (Da)
4.24
ALogP
3
HBA
1
HBD
41.5
PSA (Ų)
0.91
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H24N2OS
MW 316.47
Aromatic Rings 1
Heavy Atoms 22
NP-Likeness -0.61

Literature References

PubMed DOI Target Context # Activities
7650679 10.1021/jm00017a010 MT4 2

Data from ChEMBL 36 via Core Engine