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Compound Detail

CHEMBL5396609

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O=C(Nc1ccc(NC(=O)c2ccccn2)cc1)c1ccc(NC(=O)c2ccccn2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5396609
Phase Preclinical
Structure Type MOL
InChI Key FBRSRCTVPGVNTO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

437.5
MW (Da)
4.23
ALogP
5
HBA
3
HBD
113.1
PSA (Ų)
0.42
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H19N5O3
MW 437.46
Aromatic Rings 4
Heavy Atoms 33
NP-Likeness -0.98

Literature References

PubMed DOI Target Context # Activities
37729094 10.1021/acs.jmedchem.3c00697 Trypanosoma brucei 2
37729094 10.1021/acs.jmedchem.3c00697 Unchecked 1
37729094 10.1021/acs.jmedchem.3c00697 Trypanosoma cruzi 1
37729094 10.1021/acs.jmedchem.3c00697 L929 1
37729094 10.1021/acs.jmedchem.3c00697 Leishmania donovani 1
37729094 10.1021/acs.jmedchem.3c00697 Trichomonas vaginalis 1

Data from ChEMBL 36 via Core Engine