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

CHEMBL4446183

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](CS(=O)(=O)Cc1ccccc1)[C@@H]1CC(Br)=NO1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4446183
Phase Preclinical
Structure Type MOL
InChI Key GELAYFHIUPQTDQ-MNOVXSKESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

347.2
MW (Da)
1.43
ALogP
5
HBA
1
HBD
81.8
PSA (Ų)
0.87
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H15BrN2O3S
MW 347.23
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness -0.76

Literature References

PubMed DOI Target Context # Activities
30996801 10.1021/acsmedchemlett.8b00592 Unchecked 5
30996801 10.1021/acsmedchemlett.8b00592 Plasmodium falciparum 2
30996801 10.1021/acsmedchemlett.8b00592 HMEC-1 1

Data from ChEMBL 36 via Core Engine