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Compound Detail

CHEMBL5270591

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

Basic Information

ChEMBL ID CHEMBL5270591
Phase Preclinical
Structure Type MOL
InChI Key CZPDADPGYAWXSH-KBPBESRZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

375.4
MW (Da)
-1.78
ALogP
6
HBA
5
HBD
161.7
PSA (Ų)
0.31
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H21N7O4
MW 375.39
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.08

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