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Compound Detail

CHEMBL1195888

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O=C(O)[C@@H]1CCCN(CCOCC=C(c2ccc(F)cc2)c2ccc(F)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195888
Phase Preclinical
Structure Type MOL
InChI Key RMSAHBFSIQZSMH-LJQANCHMSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

401.4
MW (Da)
4.21
ALogP
3
HBA
1
HBD
49.8
PSA (Ų)
0.67
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 C23H25F2NO3
MW 401.45
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine