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Compound Detail

CHEMBL491342

ANGELOYLGOMISIN P
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C/C=C(/C)C(=O)O[C@@H]1c2cc(OC)c(OC)c(OC)c2-c2c(cc3c(c2OC)OCO3)C[C@H](C)[C@@]1(C)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL491342
Name ANGELOYLGOMISIN P
Phase Preclinical
Structure Type MOL
InChI Key BKGUPIVDQHHVMV-ATODGADHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

514.6
MW (Da)
4.61
ALogP
9
HBA
1
HBD
101.9
PSA (Ų)
0.44
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C28H34O9
MW 514.57
Aromatic Rings 2
Heavy Atoms 37
NP-Likeness 2.26

Literature References

PubMed DOI Target Context # Activities
17190445 10.1021/np060239e H9 1
17190445 10.1021/np060239e Human immunodeficiency virus 1 1

Data from ChEMBL 36 via Core Engine