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Compound Detail

CHEMBL513477

HORMOTHAMNIONE
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COc1c(OC)c(O)c2c(=O)c(C)c(/C=C/c3cc(O)cc(O)c3)oc2c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL513477
Name HORMOTHAMNIONE
Phase Preclinical
Structure Type MOL
InChI Key OUTWDDOLLXVXMF-AATRIKPKSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

400.4
MW (Da)
3.41
ALogP
8
HBA
3
HBD
118.6
PSA (Ų)
0.60
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C21H20O8
MW 400.38
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness 1.41

Literature References

PubMed DOI Target Context # Activities
12762791 10.1021/np0204038 HL-60 1

Data from ChEMBL 36 via Core Engine