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Compound Detail

CHEMBL1327262

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Cl.Nc1ccc2[nH]c(CCCO)nc2c1

Basic Information

ChEMBL ID CHEMBL1327262
Phase Preclinical
Structure Type MOL
InChI Key AJQYPYYWHFOFPK-UHFFFAOYSA-N
Parent Compound CHEMBL1617632
Active Moiety CHEMBL1617632
3
Targets
3
Activities
2
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

191.2
MW (Da)
1.07
ALogP
3
HBA
3
HBD
74.9
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H14ClN3O
MW 227.69
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -0.98

Activity Summary

EC50 2 meas. best 5.36
IC50 1 meas. best 5.56

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.56 5.56 2740.0 1
Zinc finger protein mex-5
CHEMBL1293319
EC50 5.36 5.36 4349.0 1
RNA-binding protein pos-1
CHEMBL1293304
EC50 4.44 4.44 36684.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine