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Compound Detail

CHEMBL5897931

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N#Cc1cccc(-c2cnc(C(=O)NCC(=O)O)c(O)c2)c1

Basic Information

ChEMBL ID CHEMBL5897931
Phase Preclinical
Structure Type MOL
InChI Key MPVNTWTVHVEUKG-UHFFFAOYSA-N
1
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

297.3
MW (Da)
1.14
ALogP
5
HBA
3
HBD
123.3
PSA (Ų)
0.78
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11N3O4
MW 297.27
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.03

Activity Summary

IC50 4 meas. best 6.72

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Egl nine homolog 1
CHEMBL5697
IC50 6.72 6.72 190.0 4

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine