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Compound Detail

CHEMBL5028209

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CN1C(=O)[C@@H](O)C[C@@H]1C(=O)N[C@@H]1CC[C@@]2(S(=O)(=O)c3ccc(F)cc3)c3ccc(C(F)(C(F)(F)F)C(F)(F)F)cc3CC[C@@H]12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5028209
Phase Preclinical
Structure Type MOL
InChI Key VVMAZBCPOZHTEH-WUDUDLAESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

654.6
MW (Da)
4.22
ALogP
5
HBA
2
HBD
103.8
PSA (Ų)
0.37
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H26F8N2O5S
MW 654.58
Aromatic Rings 2
Heavy Atoms 44
NP-Likeness -0.15

Data from ChEMBL 36 via Core Engine