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Compound Detail

CHEMBL5571306

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Cn1cc(CNCc2cccc(O)c2)c2cc(C(=O)Nc3ccc(F)cc3)ccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5571306
Phase Preclinical
Structure Type MOL
InChI Key QKIGLVUSAZVWHP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

403.5
MW (Da)
4.57
ALogP
4
HBA
3
HBD
66.3
PSA (Ų)
0.44
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H22FN3O2
MW 403.46
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.32

Literature References

PubMed DOI Target Context # Activities
39038808 10.1021/acs.jmedchem.4c00718 HeLa 1
39038808 10.1021/acs.jmedchem.4c00718 Serine/threonine-protein kinase haspin 1

Data from ChEMBL 36 via Core Engine