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Compound Detail

CHEMBL5287116

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CC(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C=O)Cc1ccc(O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5287116
Phase Preclinical
Structure Type MOL
InChI Key BNBFIUXORPLSPD-RDJZCZTQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

401.4
MW (Da)
-0.79
ALogP
6
HBA
5
HBD
153.3
PSA (Ų)
0.33
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23N5O5
MW 401.42
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness 0.09

Literature References

PubMed DOI Target Context # Activities
36332548 10.1016/j.ejmech.2022.114857 Replicase polyprotein 1ab 2

Data from ChEMBL 36 via Core Engine