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Compound Detail

CHEMBL7689

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Cc1cc(-c2c(F)cc3c(=O)c(Cc4ccc(N(C)C)cc4)cn(C4CC4)c3c2F)cc(C)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL7689
Phase Preclinical
Structure Type MOL
InChI Key HTJGFMOWJVFHBW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

459.5
MW (Da)
5.95
ALogP
4
HBA
0
HBD
38.1
PSA (Ų)
0.37
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H27F2N3O
MW 459.54
Aromatic Rings 4
Heavy Atoms 34
NP-Likeness -0.65

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