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Compound Detail

CHEMBL5647344

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Cc1ccc(-c2cc3nc(N)n(C)c(=O)c3s2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5647344
Phase Preclinical
Structure Type MOL
InChI Key OQHJCBYFQDHDAY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

271.4
MW (Da)
2.55
ALogP
5
HBA
1
HBD
60.9
PSA (Ų)
0.74
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H13N3OS
MW 271.35
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.24

Literature References

PubMed DOI Target Context # Activities
37857143 10.1016/j.ejmech.2023.115873 Plasmodium falciparum 1
37857143 10.1016/j.ejmech.2023.115873 HepG2 1

Data from ChEMBL 36 via Core Engine