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Compound Detail

CHEMBL7991

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CC(=O)Nc1ccc(Cc2cn(C3CC3)c3c(F)c(-c4cc(C)nc(C)c4)c(F)cc3c2=O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL7991
Phase Preclinical
Structure Type MOL
InChI Key LCNDKQULTJEYCA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

473.5
MW (Da)
5.84
ALogP
4
HBA
1
HBD
64.0
PSA (Ų)
0.40
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 C28H25F2N3O2
MW 473.52
Aromatic Rings 4
Heavy Atoms 35
NP-Likeness -0.72

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