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Compound Detail

CHEMBL5984887

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O=C(O)CNC(=O)c1nc(Cl)c(C#Cc2ccc(CO)cc2)cc1O

Basic Information

ChEMBL ID CHEMBL5984887
Phase Preclinical
Structure Type MOL
InChI Key IHHYLQKEMMGEDR-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

360.8
MW (Da)
1.15
ALogP
5
HBA
4
HBD
119.8
PSA (Ų)
0.48
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13ClN2O5
MW 360.75
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.46

Activity Summary

IC50 2 meas. best 6.68

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Prolyl hydroxylase EGLN3
CHEMBL5705
IC50 6.68 6.68 210.0 1
Egl nine homolog 1
CHEMBL5697
IC50 6.26 6.26 550.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine