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Compound Detail

CHEMBL5925574

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N#Cc1ccc(Oc2cn[nH]c2-c2cccc(OCc3ccc(Cl)nc3)c2F)cc1

Basic Information

ChEMBL ID CHEMBL5925574
Phase Preclinical
Structure Type MOL
InChI Key FGECSLWIOUSRCM-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

420.8
MW (Da)
5.51
ALogP
5
HBA
1
HBD
83.8
PSA (Ų)
0.42
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H14ClFN4O2
MW 420.83
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.46

Activity Summary

EC50 2 meas. best 10.55

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Cytochrome P450 11B1, mitochondrial
CHEMBL1908
EC50 10.55 10.55 0.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine