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Compound Detail

CHEMBL7722

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Cc1cc(-c2c(F)cc3c(=O)c(CC4CCCCC4)cn(C4CC4)c3c2F)cc(C)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL7722
Phase Preclinical
Structure Type MOL
InChI Key ZPPRSCBDXBVICX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

422.5
MW (Da)
6.42
ALogP
3
HBA
0
HBD
34.9
PSA (Ų)
0.49
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H28F2N2O
MW 422.52
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -0.48

Literature References

PubMed DOI Target Context # Activities
- 10.1016/0960-894X(95)00160-U DNA topoisomerase II 1

Data from ChEMBL 36 via Core Engine