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Compound Detail

CHEMBL5612608

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Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)Nc3nnc4ccccn34)c12

Basic Information

ChEMBL ID CHEMBL5612608
Phase Preclinical
Structure Type MOL
InChI Key ALILACQTYCFUTO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

389.5
MW (Da)
3.67
ALogP
7
HBA
1
HBD
90.0
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H23N7O
MW 389.46
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -2.28

Literature References

PubMed DOI Target Context # Activities
39024967 10.1016/j.ejmech.2024.116677 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine