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Compound Detail

CHEMBL16393

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COCON1C(=O)C(CC(C)C)=N/C(=C\C(C)C)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL16393
Phase Preclinical
Structure Type MOL
InChI Key SPNZLGIPSZGSEQ-WDZFZDKYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

282.3
MW (Da)
1.92
ALogP
5
HBA
0
HBD
68.2
PSA (Ų)
0.42
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 C14H22N2O4
MW 282.34
Aromatic Rings 0
Heavy Atoms 20
NP-Likeness 0.27

Literature References

PubMed DOI Target Context # Activities
12646026 10.1021/jm020334u Polymerase acidic protein 1
11485475 10.1021/jo015665d Polymerase acidic protein 1

Data from ChEMBL 36 via Core Engine