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Compound Detail

CHEMBL5877805

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N#CN1CCC[C@H]1C(=O)N1CCc2c(-c3ccncn3)cccc21

Basic Information

ChEMBL ID CHEMBL5877805
Phase Preclinical
Structure Type MOL
InChI Key SOGGLSWYHHABAC-KRWDZBQOSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

319.4
MW (Da)
1.98
ALogP
5
HBA
0
HBD
73.1
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 C18H17N5O
MW 319.37
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -1.01

Activity Summary

IC50 2 meas. best 5.26

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
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