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Compound Detail

CHEMBL5630802

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Oc1ccccc1C(c1ccc(F)cc1)N1CCN(c2ccnc3cc(Cl)ccc23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5630802
Phase Preclinical
Structure Type MOL
InChI Key GUVOTZVUEBGCJN-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

447.9
MW (Da)
5.64
ALogP
4
HBA
1
HBD
39.6
PSA (Ų)
0.44
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H23ClFN3O
MW 447.94
Aromatic Rings 4
Heavy Atoms 32
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
37321109 10.1016/j.ejmech.2023.115564 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine