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

CHEMBL255982

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
CC[C@H](NC(=O)[C@H](CS(=O)(=O)Cc1ccccc1)OC(=O)N1CCOCC1)C(=O)c1nc2ccccc2o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL255982
Phase Preclinical
Structure Type MOL
InChI Key LXHNDYSVBOVADI-UGKGYDQZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

543.6
MW (Da)
2.36
ALogP
9
HBA
1
HBD
145.1
PSA (Ų)
0.38
QED
1
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H29N3O8S
MW 543.60
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -1.05

Literature References

PubMed DOI Target Context # Activities
18053726 10.1016/j.bmc.2007.11.015 Cathepsin S 1

Data from ChEMBL 36 via Core Engine