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

CHEMBL3104247

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
O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1cccc(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3104247
Phase Preclinical
Structure Type MOL
InChI Key CNZJIFMICCWVNM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

441.9
MW (Da)
1.57
ALogP
5
HBA
2
HBD
104.8
PSA (Ų)
0.70
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H17ClFN3O5S
MW 441.87
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -2.56

Literature References

PubMed DOI Target Context # Activities
24237195 10.1021/jm400870h T47D 1
24237195 10.1021/jm400870h Lysine-specific histone demethylase 1A 1

Data from ChEMBL 36 via Core Engine