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Compound Detail

CHEMBL2367682

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CC(C)Nc1nc2cc(Cl)c(Cl)cc2n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2367682
Phase Preclinical
Structure Type MOL
InChI Key AADWXNSPSUHKKF-AAVRWANBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

378.2
MW (Da)
2.75
ALogP
6
HBA
3
HBD
79.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H18Cl2FN3O3
MW 378.23
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.11

Literature References

PubMed DOI Target Context # Activities
10882375 10.1021/jm990219s HFF 2
10882375 10.1021/jm990219s Human alphaherpesvirus 1 1
10882375 10.1021/jm990219s ADMET 1

Data from ChEMBL 36 via Core Engine