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Compound Detail

CHEMBL5270449

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

Basic Information

ChEMBL ID CHEMBL5270449
Phase Preclinical
Structure Type MOL
InChI Key ICYSRTWXEGHQLP-MRVPVSSYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

378.4
MW (Da)
2.68
ALogP
7
HBA
3
HBD
111.8
PSA (Ų)
0.60
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17F3N6O
MW 378.36
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.19

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