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Compound Detail

CHEMBL5557222

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CC(C)C[C@H](N)C(=O)O[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2CC[C@]2(C)C(O)=CC[C@@H]32)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5557222
Phase Preclinical
Structure Type MOL
InChI Key SVHCGWCVFIHTBU-YMKPZFJOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

401.6
MW (Da)
5.29
ALogP
4
HBA
2
HBD
72.5
PSA (Ų)
0.50
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H39NO3
MW 401.59
Aromatic Rings 0
Heavy Atoms 29
NP-Likeness 1.77

Literature References

PubMed DOI Target Context # Activities
38467086 10.1016/j.ejmech.2024.116296 B16 1

Data from ChEMBL 36 via Core Engine