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Compound Detail

CHEMBL5960859

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COC(=O)/C=C/c1ccc2nccc(C(=O)NCC(=O)N3CC(F)(F)C[C@H]3C#N)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5960859
Phase Preclinical
Structure Type MOL
InChI Key MCEILMXJQWOLAE-KQIUPUNMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

428.4
MW (Da)
1.91
ALogP
6
HBA
1
HBD
112.4
PSA (Ų)
0.58
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H18F2N4O4
MW 428.40
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine