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Compound Detail

CHEMBL6023548

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N#Cc1cccc(-c2cccc3c2CCN3C(=O)[C@@H]2CCCN2C#N)c1

Basic Information

ChEMBL ID CHEMBL6023548
Phase Preclinical
Structure Type MOL
InChI Key WNYLPSCEQVXVEU-FQEVSTJZSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

342.4
MW (Da)
3.06
ALogP
4
HBA
0
HBD
71.1
PSA (Ų)
0.79
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H18N4O
MW 342.40
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.96

Activity Summary

IC50 4 meas. best 5.26

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Ubiquitin carboxyl-terminal hydrolase 30
CHEMBL4523357
IC50 5.26 5.26 5500.0 2
Ubiquitin carboxyl-terminal hydrolase isozyme L1
CHEMBL6159
IC50 5.26 5.26 5500.0 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine