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Compound Detail

CHEMBL5437349

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Cc1cccc(S(=O)(=O)NCc2cn(C[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)nn2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5437349
Phase Preclinical
Structure Type MOL
InChI Key CTWCDOOXXHTYLS-WVSUBDOOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

501.5
MW (Da)
-0.89
ALogP
13
HBA
4
HBD
196.2
PSA (Ų)
0.24
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23N9O5S
MW 501.53
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -0.80

Literature References

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

Data from ChEMBL 36 via Core Engine