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

CHEMBL199349

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@@H](Cc1cccc2ccccc12)C(=O)N1CCSC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL199349
Phase Preclinical
Structure Type MOL
InChI Key FGWHNYBNIVMZSE-HNNXBMFYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

286.4
MW (Da)
2.24
ALogP
3
HBA
1
HBD
46.3
PSA (Ų)
0.94
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 C16H18N2OS
MW 286.40
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.76

Literature References

PubMed DOI Target Context # Activities
16236500 10.1016/j.bmcl.2005.09.037 Dipeptidyl peptidase 4 1

Data from ChEMBL 36 via Core Engine