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Compound Detail

CHEMBL5439737

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Nc1ncnc2c1ncn2[C@@H]1O[C@H](Cn2cc(CNS(=O)(=O)c3ccccc3)nn2)[C@@H](O)[C@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5439737
Phase Preclinical
Structure Type MOL
InChI Key IFQMWIYYEDXYOE-NVQRDWNXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

487.5
MW (Da)
-1.20
ALogP
13
HBA
4
HBD
196.2
PSA (Ų)
0.24
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H21N9O5S
MW 487.50
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.62

Literature References

PubMed DOI Target Context # Activities
38516599 10.1039/d3md00737e Replicase polyprotein 1ab 2

Data from ChEMBL 36 via Core Engine