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Compound Detail

CHEMBL5807159

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O=C(c1nc2n(n1)[C@H](c1ccccc1)C[C@@H]2O)C1CC1

Basic Information

ChEMBL ID CHEMBL5807159
Phase Preclinical
Structure Type MOL
InChI Key HAMZRZRYHAYBEL-RYUDHWBXSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

269.3
MW (Da)
1.90
ALogP
5
HBA
1
HBD
68.0
PSA (Ų)
0.86
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H15N3O2
MW 269.30
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.56

Activity Summary

Ki 1 meas. best 7.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Receptor-interacting serine/threonine-protein kinase 1
CHEMBL5464
Ki 7.89 7.89 13.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine