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Compound Detail

CHEMBL5557045

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CN1CCN(S(=O)(=O)c2cc(NCC(=O)Nc3ccc(F)c(Cl)c3)ccc2Cl)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5557045
Phase Preclinical
Structure Type MOL
InChI Key YTJRNBCUWQKJJW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

475.4
MW (Da)
3.12
ALogP
5
HBA
2
HBD
81.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H21Cl2FN4O3S
MW 475.37
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -2.49

Literature References

PubMed DOI Target Context # Activities
38554474 10.1016/j.ejmech.2024.116354 Plasmodium falciparum 1
38554474 10.1016/j.ejmech.2024.116354 HepG2 1

Data from ChEMBL 36 via Core Engine