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Compound Detail

CHEMBL399845

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O=C(COc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)Nc1cncc(C(=O)O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL399845
Phase Preclinical
Structure Type MOL
InChI Key RDQSNARBRVOISS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

406.5
MW (Da)
4.27
ALogP
4
HBA
2
HBD
88.5
PSA (Ų)
0.75
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H26N2O4
MW 406.48
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -1.01

Literature References

PubMed DOI Target Context # Activities
17884495 10.1016/j.bmcl.2007.09.005 Hypoxia-inducible factor 1-alpha 3

Data from ChEMBL 36 via Core Engine