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Compound Detail

CHEMBL5963783

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Cn1ccc(-c2cc(C(=O)Nc3cc4c(nc3-c3ccccc3)CCNC4=O)c(F)cc2C(F)(F)F)n1

Basic Information

ChEMBL ID CHEMBL5963783
Phase Preclinical
Structure Type MOL
InChI Key LDRWEKPIACIMDT-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

509.5
MW (Da)
4.85
ALogP
5
HBA
2
HBD
88.9
PSA (Ų)
0.39
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H19F4N5O2
MW 509.46
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -1.28

Activity Summary

IC50 1 meas. best 10.16

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
High affinity nerve growth factor receptor
CHEMBL2815
IC50 10.16 10.16 0.1 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine