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Compound Detail

CHEMBL5568682

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CN1C(=O)c2c(O)c(=O)ccn2N2[C@@H](c3ccccc3)c3ccccc3OCC[C@H]12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5568682
Phase Preclinical
Structure Type MOL
InChI Key YFYBUCKMRBVABQ-UXHICEINSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

403.4
MW (Da)
2.48
ALogP
6
HBA
1
HBD
75.0
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H21N3O4
MW 403.44
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness 0.01

Literature References

PubMed DOI Target Context # Activities
38301207 10.1021/acs.jmedchem.3c01715 Influenza A virus 4

Data from ChEMBL 36 via Core Engine