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Compound Detail

CHEMBL81533

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CCCCCCCCc1cccc([C@@H](O)[C@@H](N)CO)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL81533
Phase Preclinical
Structure Type MOL
InChI Key MJSMPWUAWZJCOQ-HOCLYGCPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

280.4
MW (Da)
2.34
ALogP
4
HBA
3
HBD
79.4
PSA (Ų)
0.57
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H28N2O2
MW 280.41
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 0.21

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00427-U Protein kinase C (PKC) 1

Data from ChEMBL 36 via Core Engine