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Compound Detail

CHEMBL425207

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N#C/C(=C\c1ccc(O)c(O)c1)C(=O)OCCCCCCOC(=O)/C(C#N)=C/c1ccc(O)c(O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL425207
Phase Preclinical
Structure Type MOL
InChI Key KJLSCXWRGNSNDI-AYKLPDECSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

492.5
MW (Da)
3.67
ALogP
10
HBA
4
HBD
181.1
PSA (Ų)
0.12
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H24N2O8
MW 492.48
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness 0.05

Literature References

PubMed DOI Target Context # Activities
16302817 10.1021/jm040208l Dynamin-1 1

Data from ChEMBL 36 via Core Engine