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Compound Detail

CHEMBL1236070

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C[C@]12CC[C@@H]3c4ccc(O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]5O)cc4CC[C@H]3[C@@H]1C[C@@H](O)[C@@H]2O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1236070
Phase Preclinical
Structure Type MOL
InChI Key UZKIAJMSMKLBQE-JRSYHJKYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

464.5
MW (Da)
0.15
ALogP
8
HBA
6
HBD
156.9
PSA (Ų)
0.37
QED
1
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 C24H32O9
MW 464.51
Aromatic Rings 1
Heavy Atoms 33
NP-Likeness 2.20

Literature References

PubMed DOI Target Context # Activities
12527806 10.1124/mol.63.2.351 ATP-binding cassette sub-family C member 10 1
23288867 10.1124/dmd.112.049072 UDP-glucuronosyltransferase 1A10 1

Data from ChEMBL 36 via Core Engine