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Compound Detail

CHEMBL5406827

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CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(N)=O)C(=O)C(=O)Nc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5406827
Phase Preclinical
Structure Type MOL
InChI Key PPBHCWKIAYUMIN-SFTDATJTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

496.6
MW (Da)
2.29
ALogP
6
HBA
4
HBD
156.7
PSA (Ų)
0.31
QED
0
Ro5 Violations
13
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H32N4O6
MW 496.56
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.42

Literature References

PubMed DOI Target Context # Activities
37595260 10.1021/acs.jmedchem.3c00810 Replicase polyprotein 1ab 2

Data from ChEMBL 36 via Core Engine