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Compound Detail

CHEMBL150865

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NC1CCCc2onc(O)c21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL150865
Phase Preclinical
Structure Type MOL
InChI Key OAJLTKZYCPGQMS-UHFFFAOYSA-N
0
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

154.2
MW (Da)
0.72
ALogP
4
HBA
2
HBD
72.3
PSA (Ų)
0.58
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H10N2O2
MW 154.17
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness -0.11

Activity Summary

IC50 3 meas.

Literature References

PubMed DOI Target Context # Activities
10639282 10.1021/jm9904452 Mus musculus 2
10639282 10.1021/jm9904452 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine