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Compound Detail

CHEMBL3208631

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Cc1ccc(F)cc1/N=C/c1c(O)oc2ccccc2c1=O

Basic Information

ChEMBL ID CHEMBL3208631
Phase Preclinical
Structure Type MOL
InChI Key YXGBLPZHZGVMNE-DJKKODMXSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

297.3
MW (Da)
3.70
ALogP
4
HBA
1
HBD
62.8
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H12FNO3
MW 297.29
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -0.73

Activity Summary

EC50 3 meas. best 5.21

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
EC50 5.21 5.0833 6170.0 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine