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Compound Detail

CHEMBL2346957

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Cl.N#Cc1ccc(/C=N/NC(=N)N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2346957
Phase Preclinical
Structure Type MOL
InChI Key KSPMYRYFPLBEKN-AWFSDRIXSA-N
Parent Compound CHEMBL2365639
Active Moiety CHEMBL2365639
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

187.2
MW (Da)
0.38
ALogP
3
HBA
3
HBD
98.0
PSA (Ų)
0.35
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H10ClN5
MW 223.67
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -1.85

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
33640673 10.1016/j.ejmech.2021.113293 Staphylococcus aureus 2
23465801 10.1016/j.bmc.2013.01.051 Glutamate [NMDA] receptor 1

Data from ChEMBL 36 via Core Engine