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Compound Detail

CHEMBL1535241

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Cc1ccc(N=Nc2c(O)n(CN3CCOCC3)c3ccccc23)cc1

Basic Information

ChEMBL ID CHEMBL1535241
Phase Preclinical
Structure Type MOL
InChI Key CCUONORJTUMTFB-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.4
MW (Da)
4.36
ALogP
6
HBA
1
HBD
62.4
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22N4O2
MW 350.42
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.33

Activity Summary

EC50 2 meas. best 4.41

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Endoribonuclease toxin MazF
CHEMBL1795096
EC50 4.41 4.355 39400.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine