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Compound Detail

CHEMBL1483095

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CCOC(=O)Cn1c2ccc(OC)cc2c2nc3ccccc3nc21

Basic Information

ChEMBL ID CHEMBL1483095
Phase Preclinical
Structure Type MOL
InChI Key RLTLXQYERPJJEF-UHFFFAOYSA-N
4
Targets
4
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

335.4
MW (Da)
3.31
ALogP
6
HBA
0
HBD
66.2
PSA (Ų)
0.54
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17N3O3
MW 335.36
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.15

Activity Summary

EC50 3 meas. best 6.06
IC50 1 meas. best 5.36

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
RNA-binding protein pos-1
CHEMBL1293304
EC50 6.06 6.06 862.0 1
Zinc finger protein mex-5
CHEMBL1293319
EC50 5.65 5.65 2258.0 1
Voltage-gated N-type calcium channel alpha-1B subunit/Amyloid beta A4 precursor protein-binding family A member 1
CHEMBL2097170
IC50 5.36 5.36 4340.0 1
Endoribonuclease toxin MazF
CHEMBL1795096
EC50 4.29 4.29 50700.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine