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Compound Detail

CHEMBL2219824

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CCN(CCO)C[C@H]1CC[C@H](CCN(C)C(=O)Oc2ccc(C(F)(F)F)cc2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2219824
Phase Preclinical
Structure Type MOL
InChI Key MUXRZYNIEMIEAL-IYARVYRRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

430.5
MW (Da)
4.65
ALogP
4
HBA
1
HBD
53.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H33F3N2O3
MW 430.51
Aromatic Rings 1
Heavy Atoms 30
NP-Likeness -1.07

Data from ChEMBL 36 via Core Engine