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Compound Detail

CHEMBL317503

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CCCCCCCCCCC(C)(C)NC(=O)c1c(OC)cc(OC)cc1OC

Basic Information

ChEMBL ID CHEMBL317503
Phase Preclinical
Structure Type MOL
InChI Key XLECRPQYACYKMX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

393.6
MW (Da)
5.75
ALogP
4
HBA
1
HBD
56.8
PSA (Ų)
0.41
QED
1
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H39NO4
MW 393.57
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness -0.06

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00024-N Sterol O-acyltransferase 1 1
- 10.1016/0960-894X(95)00024-N Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine