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Compound Detail

CHEMBL5571126

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N#Cc1cccc(CN2CCc3[nH]c(NCc4cccc(F)c4)nc(=O)c3C2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5571126
Phase Preclinical
Structure Type MOL
InChI Key JSOVNCZQFMVTDJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

389.4
MW (Da)
2.95
ALogP
5
HBA
2
HBD
84.8
PSA (Ų)
0.70
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H20FN5O
MW 389.43
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -2.00

Literature References

PubMed DOI Target Context # Activities
38620134 10.1021/acs.jmedchem.4c00338 ATP-dependent Clp protease proteolytic subunit, mitochondrial 2
38620134 10.1021/acs.jmedchem.4c00338 MV4-11 1

Data from ChEMBL 36 via Core Engine