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Compound Detail

CHEMBL1181514

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C[C@H]1C2Cc3ccc(O)cc3[C@@]1(C)CCN2CC(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1181514
Phase Preclinical
Structure Type MOL
InChI Key UYHYBDMESSELSN-WAJWKUKPSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

299.3
MW (Da)
3.48
ALogP
2
HBA
1
HBD
23.5
PSA (Ų)
0.86
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H20F3NO
MW 299.34
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.97

Data from ChEMBL 36 via Core Engine