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Compound Detail

CHEMBL5793260

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O=C1NCCCOc2ncc(F)cc2[C@H]2COC(=O)N2c2ccn3ncc1c3n2

Basic Information

ChEMBL ID CHEMBL5793260
Phase Preclinical
Structure Type MOL
InChI Key HODOGORARXFPKU-CYBMUJFWSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

398.4
MW (Da)
1.47
ALogP
8
HBA
1
HBD
111.0
PSA (Ų)
0.61
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15FN6O4
MW 398.35
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -0.96

Activity Summary

IC50 3 meas. best 7.26

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
High affinity nerve growth factor receptor
CHEMBL2815
IC50 7.26 7.26 55.0 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine