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Compound Detail

CHEMBL2391962

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CC1COP(=S)(Oc2ccc(C(F)(F)F)cc2)N1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2391962
Phase Preclinical
Structure Type MOL
InChI Key OKMMXFGRMXJMQB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

297.2
MW (Da)
3.32
ALogP
3
HBA
1
HBD
30.5
PSA (Ų)
0.85
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 C10H11F3NO2PS
MW 297.24
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.49

Literature References

PubMed DOI Target Context # Activities
23659857 10.1016/j.bmcl.2013.04.026 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine