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

CHEMBL1946760

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
COc1cc2c(cc1Cl)NC(N[C@@H](C)CO)=NS2(=O)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1946760
Phase Preclinical
Structure Type MOL
InChI Key AEVJNSJUOFUSKL-LURJTMIESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

319.8
MW (Da)
0.79
ALogP
6
HBA
3
HBD
100.0
PSA (Ų)
0.76
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 C11H14ClN3O4S
MW 319.77
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness -0.96

Literature References

PubMed DOI Target Context # Activities
22077416 10.1021/jm200786z ATP-binding cassette sub-family C member 8 4
22077416 10.1021/jm200786z Molecular identity unknown 1
22077416 10.1021/jm200786z Unchecked 1

Data from ChEMBL 36 via Core Engine