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Compound Detail

CHEMBL608771

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OC[C@H]1OC(n2c(Cl)nc3cc(F)c(F)cc32)[C@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL608771
Phase Preclinical
Structure Type MOL
InChI Key ITDJEYVPFRMYES-QHPFDFDXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

320.7
MW (Da)
0.58
ALogP
6
HBA
3
HBD
87.7
PSA (Ų)
0.75
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H11ClF2N2O4
MW 320.68
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness 0.15

Literature References

PubMed DOI Target Context # Activities
9057868 10.1021/jm960462g Human betaherpesvirus 5 2
9057868 10.1021/jm960462g Human alphaherpesvirus 1 1
9057868 10.1021/jm960462g HFF 1
9057868 10.1021/jm960462g KB 1

Data from ChEMBL 36 via Core Engine