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Compound Detail

CHEMBL2365484

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CN(CCC[C@]1(O)[C@H]2CCN(CC(F)F)[C@@H]1Cc1ccc(O)c(O)c12)C(=O)/C=C/c1ccoc1

Basic Information

ChEMBL ID CHEMBL2365484
Phase Preclinical
Structure Type MOL
InChI Key ZXNOOIDEBMVKMD-JRRJBUHQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

476.5
MW (Da)
3.35
ALogP
6
HBA
3
HBD
97.4
PSA (Ų)
0.40
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H30F2N2O5
MW 476.52
Aromatic Rings 2
Heavy Atoms 34
NP-Likeness 0.74

Data from ChEMBL 36 via Core Engine