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Compound Detail

CHEMBL5274264

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CN(C)c1ccc2cc(-c3ccsc3)c(N)nc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5274264
Phase Preclinical
Structure Type MOL
InChI Key KUIOPMBYBZJOEE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

269.4
MW (Da)
3.61
ALogP
4
HBA
1
HBD
42.1
PSA (Ų)
0.77
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H15N3S
MW 269.37
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.71

Literature References

PubMed DOI Target Context # Activities
34355566 10.1021/acs.jmedchem.1c00813 Leishmania mexicana 1
34355566 10.1021/acs.jmedchem.1c00813 J774.A1 1
34355566 10.1021/acs.jmedchem.1c00813 ADMET 1

Data from ChEMBL 36 via Core Engine