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Compound Detail

CHEMBL5844336

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CN(C)CCOc1cc2ncnc(Oc3ccc(NC(=O)NC4CC4)c(Cl)c3)c2c2c1OCCO2

Basic Information

ChEMBL ID CHEMBL5844336
Phase Preclinical
Structure Type MOL
InChI Key LUAFTGUZYHOFJP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

500.0
MW (Da)
4.07
ALogP
8
HBA
2
HBD
107.1
PSA (Ų)
0.48
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H26ClN5O5
MW 499.96
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -1.37

Activity Summary

IC50 1 meas. best 6.56

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 6.56 6.56 275.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine