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Compound Detail

CHEMBL3192451

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COc1ccc(/C(C)=N/Nc2nc3ccccc3nc2C)cc1OC

Basic Information

ChEMBL ID CHEMBL3192451
Phase Preclinical
Structure Type MOL
InChI Key REGCEEMYKZEAEG-WSDLNYQXSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

336.4
MW (Da)
3.79
ALogP
6
HBA
1
HBD
68.6
PSA (Ų)
0.57
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H20N4O2
MW 336.40
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.05

Activity Summary

EC50 2 meas. best 5.29

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
RNA-binding protein pos-1
CHEMBL1293304
EC50 5.29 5.29 5066.0 1
Zinc finger protein mex-5
CHEMBL1293319
EC50 4.18 4.18 66495.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine