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Compound Detail

CHEMBL5406659

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CCN(CC)CCCNc1cc2nc(/C=C/c3ccc(C(C)C)cc3)n(CCC#N)c(=O)c2cc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5406659
Phase Preclinical
Structure Type MOL
InChI Key BSPXLUCUMSJMKM-SDNWHVSQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

489.6
MW (Da)
5.89
ALogP
6
HBA
1
HBD
74.0
PSA (Ų)
0.32
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H36FN5O
MW 489.64
Aromatic Rings 3
Heavy Atoms 36
NP-Likeness -1.49

Literature References

PubMed DOI Target Context # Activities
36459756 10.1016/j.ejmech.2022.114944 RecQ-like DNA helicase BLM 2

Data from ChEMBL 36 via Core Engine