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

CHEMBL3545330

MSX-122
Phase I
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
Phase I
c1cnc(NCc2ccc(CNc3ncccn3)cc2)nc1

Basic Information

ChEMBL ID CHEMBL3545330
Name MSX-122
Phase Phase I
Structure Type MOL
InChI Key PXZXYRKDDXKDTK-UHFFFAOYSA-N

Known Names

Msx 122 Msx-122
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
13
Publications
2
Known Names
1
Indications
1
Mechanisms

Molecular Properties

292.4
MW (Da)
2.49
ALogP
6
HBA
2
HBD
75.6
PSA (Ų)
0.73
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product

Extended Properties

Molecular Formula C16H16N6
MW 292.35
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -0.89

Mechanism of Action

Mechanism Action Type Target Direct Efficacy
C-X-C chemokine receptor type 4 antagonist ANTAGONIST C-X-C chemokine receptor type 4

Indications

Neoplasms

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4513161 Pseudomonas aeruginosa 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1
- 10.6019/CHEMBL4513161 Candida albicans 1
- 10.6019/CHEMBL4513161 Cryptococcus neoformans 1
- 10.6019/CHEMBL4513161 Escherichia coli 1
- 10.6019/CHEMBL4513161 Klebsiella pneumoniae 1
- 10.6019/CHEMBL4513161 Acinetobacter baumannii 1
- 10.6019/CHEMBL4513161 Staphylococcus aureus 1
- 10.6019/CHEMBL4513161 Erythrocyte 1
- 10.6019/CHEMBL4513161 HEK293 1

Data from ChEMBL 36 via Core Engine