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Compound Detail

CHEMBL5288876

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CC(=O)N1CCC(c2cc3c(Nc4cccc(C(F)(F)F)c4)ncnc3n(C)c2=O)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5288876
Phase Preclinical
Structure Type MOL
InChI Key ULDOBRNDBLUKPH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

445.4
MW (Da)
3.82
ALogP
6
HBA
1
HBD
80.1
PSA (Ų)
0.66
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H22F3N5O2
MW 445.44
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -1.27

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