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Compound Detail

CHEMBL419162

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CC(C)(C)c1cc(C(=O)Nc2ccc(Cl)c(Cl)c2)c(O)c(C(C)(C)C)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL419162
Phase Preclinical
Structure Type MOL
InChI Key LSWKPTLAMUAXFZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

394.3
MW (Da)
6.55
ALogP
2
HBA
2
HBD
49.3
PSA (Ų)
0.61
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H25Cl2NO2
MW 394.34
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -1.12

Literature References

PubMed DOI Target Context # Activities
9685233 10.1021/jm9803572 KinA/Spo0F (sporulation kinase A/sporulation initiation phosphotransferase F) 1

Data from ChEMBL 36 via Core Engine