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Compound Detail

CHEMBL5619034

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O=C1CN(c2c(O)cc(NC(=O)NC3CCCCC3)cc2F)S(=O)(=O)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5619034
Phase Preclinical
Structure Type MOL
InChI Key NQDGBVHJNYSFAV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

386.4
MW (Da)
1.17
ALogP
5
HBA
4
HBD
127.8
PSA (Ų)
0.62
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H19FN4O5S
MW 386.41
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
39178726 10.1016/j.ejmech.2024.116774 Tyrosine-protein phosphatase non-receptor type 2 1
39178726 10.1016/j.ejmech.2024.116774 B16 1

Data from ChEMBL 36 via Core Engine