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Compound Detail

CHEMBL1205242

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C[C@@H](C(=O)O)N(C)C(=O)c1ccc(NC(=O)[C@@](C)(O)C(F)(F)F)c(Cl)c1

Basic Information

ChEMBL ID CHEMBL1205242
Phase Preclinical
Structure Type MOL
InChI Key ZOPYDEDEHVUGTC-JKYUHCHBSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

396.8
MW (Da)
2.14
ALogP
4
HBA
3
HBD
106.9
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H16ClF3N2O5
MW 396.75
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness -1.11

Data from ChEMBL 36 via Core Engine