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

CHEMBL5173569

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
FC(F)(F)c1cccc(Nc2nc(Nc3ncc(-c4ccsc4)cn3)ncc2Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5173569
Phase Preclinical
Structure Type MOL
InChI Key ZEUPIZNEEJEXDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

448.9
MW (Da)
6.15
ALogP
7
HBA
2
HBD
75.6
PSA (Ų)
0.38
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H12ClF3N6S
MW 448.86
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.94

Literature References

PubMed DOI Target Context # Activities
35429909 10.1016/j.ejmech.2022.114368 Dipeptidyl peptidase 1 3

Data from ChEMBL 36 via Core Engine