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Compound Detail

CHEMBL5500194

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CONC(=O)C1=C(C(=O)Nc2c(F)cc(-c3cccc(OC)c3)cc2F)CCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5500194
Phase Preclinical
Structure Type MOL
InChI Key CLBGIXWSSHQOAT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

402.4
MW (Da)
3.74
ALogP
4
HBA
2
HBD
76.7
PSA (Ų)
0.72
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H20F2N2O4
MW 402.40
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.85

Data from ChEMBL 36 via Core Engine