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Compound Detail

CHEMBL1852441

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COc1cc2ccnc(Cc3cccc(F)c3)c2cc1OCCF
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1852441
Phase Preclinical
Structure Type MOL
InChI Key QMJOTZLUOYHKFI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
4.32
ALogP
3
HBA
0
HBD
31.4
PSA (Ų)
0.67
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17F2NO2
MW 329.35
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine