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Compound Detail

CHEMBL5290546

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C[C@@H](Nc1ncnc2c1cc(NC1CCCCC1)c(=O)n2C)c1cc(N)cc(C(F)(F)F)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5290546
Phase Preclinical
Structure Type MOL
InChI Key BDKLQRXAOWKJSQ-CYBMUJFWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

460.5
MW (Da)
4.85
ALogP
7
HBA
3
HBD
97.9
PSA (Ų)
0.47
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H27F3N6O
MW 460.50
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.17

Literature References

PubMed DOI Target Context # Activities
36793426 10.1021/acsmedchemlett.2c00490 Son of sevenless homolog 1 1

Data from ChEMBL 36 via Core Engine