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

CHEMBL342820

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=c1[nH]c2c(Cl)c(Cl)c(Cl)cc2n(O)c1=O

Basic Information

ChEMBL ID CHEMBL342820
Phase Preclinical
Structure Type MOL
InChI Key RGXUOTJORUIBQP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

281.5
MW (Da)
1.89
ALogP
4
HBA
2
HBD
75.1
PSA (Ų)
0.44
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H3Cl3N2O3
MW 281.48
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.44

Activity Summary

IC50 1 meas. best 5.6

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.6 5.6 2500.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 2500.0 nM 5.6 Electrophysiological assays in Xenopus oocytes expressing cloned NMDA receptor (... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(96)00036-4 Glutamate receptor ionotropic, NMDA 1 1
- 10.1016/0960-894X(96)00036-4 Unchecked 1

Data from ChEMBL 36 via Core Engine