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Compound Detail

CHEMBL1558970

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COc1ccccc1N1CCN(C(=O)c2cc(-c3ccc(F)cc3)[nH]c2C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1558970
Phase Preclinical
Structure Type MOL
InChI Key LTAURVYDNSCAQT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

393.5
MW (Da)
4.10
ALogP
3
HBA
1
HBD
48.6
PSA (Ų)
0.73
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 C23H24FN3O2
MW 393.46
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.46

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4888484 Plasmodium falciparum 2

Data from ChEMBL 36 via Core Engine