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Compound Detail

CHEMBL477080

ARTELINIC_ACID
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C[C@H]1[C@@H](OCc2ccc(C(=O)O)cc2)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@@]24OO3

Basic Information

ChEMBL ID CHEMBL477080
Name ARTELINIC_ACID
Phase Preclinical
Structure Type MOL
InChI Key UVNHKOOJXSALHN-DPLKYLHHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

418.5
MW (Da)
4.11
ALogP
6
HBA
1
HBD
83.5
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H30O7
MW 418.49
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness 2.57

Data from ChEMBL 36 via Core Engine