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Compound Detail

CHEMBL229342

ANTROCAMPHIN B
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COc1cc(OC)c(OC)c(C)c1C#CC(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL229342
Name ANTROCAMPHIN B
Phase Preclinical
Structure Type MOL
InChI Key IKGSJDIGQRJKDN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

248.3
MW (Da)
1.96
ALogP
4
HBA
0
HBD
44.8
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C14H16O4
MW 248.28
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness 0.99

Literature References

PubMed DOI Target Context # Activities
17559265 10.1021/np070045e Neutrophil 1

Data from ChEMBL 36 via Core Engine