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Compound Detail

CHEMBL5408311

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CCn1c(=O)c([N+](=O)[O-])c(N2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5408311
Phase Preclinical
Structure Type MOL
InChI Key POAFJMRXYIGPGS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

504.5
MW (Da)
5.12
ALogP
6
HBA
0
HBD
71.6
PSA (Ų)
0.27
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H26F2N4O3
MW 504.54
Aromatic Rings 4
Heavy Atoms 37
NP-Likeness -1.23

Literature References

PubMed DOI Target Context # Activities
37465293 10.1021/acsmedchemlett.3c00063 Raji 2

Data from ChEMBL 36 via Core Engine