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Compound Detail

CHEMBL409811

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O=C(NC(Cc1ccccc1)C(=O)N1CCC(O)CC1)c1ccc[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL409811
Phase Preclinical
Structure Type MOL
InChI Key FBZAOBSDYCUZGG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

341.4
MW (Da)
1.34
ALogP
3
HBA
3
HBD
85.4
PSA (Ų)
0.77
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23N3O3
MW 341.41
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.65

Literature References

PubMed DOI Target Context # Activities
17194716 10.1124/dmd.106.013888 Lanosterol 14-alpha demethylase 1

Data from ChEMBL 36 via Core Engine