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Compound Detail

CHEMBL6027090

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COP(=O)(OC)c1cnc(N)c(-c2ccc(NC(=O)Nc3cccc(C(F)(F)F)c3)cc2)c1

Basic Information

ChEMBL ID CHEMBL6027090
Phase Preclinical
Structure Type MOL
InChI Key ANGIHPLFWQJTBG-UHFFFAOYSA-N
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

480.4
MW (Da)
5.10
ALogP
6
HBA
3
HBD
115.6
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 C21H20F3N4O4P
MW 480.38
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.10

Activity Summary

IC50 3 meas. best 7.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Platelet-derived growth factor receptor beta
CHEMBL1913
IC50 7.24 7.24 57.0 1
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 7.24 7.24 57.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine