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Compound Detail

CHEMBL3262120

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O=C1/C(=C/c2ccccc2)Oc2cc(-c3ccc(F)cc3)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3262120
Phase Preclinical
Structure Type MOL
InChI Key CCJBUYSPEQNUHQ-NDENLUEZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

316.3
MW (Da)
5.11
ALogP
2
HBA
0
HBD
26.3
PSA (Ų)
0.61
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H13FO2
MW 316.33
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.56

Literature References

PubMed DOI Target Context # Activities
24813880 10.1016/j.ejmech.2014.04.076 Unchecked 2
24813880 10.1016/j.ejmech.2014.04.076 Plasmodium falciparum 1
24813880 10.1016/j.ejmech.2014.04.076 HEK-293T 1

Data from ChEMBL 36 via Core Engine