Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL3990391

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
CN(C)CCOc1ccc(/C(=C(/CCC(F)F)c2ccccc2)c2ccc(Br)cc2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3990391
Phase Preclinical
Structure Type MOL
InChI Key WBDBUZYCNQWVOO-RFBIWTDZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

500.4
MW (Da)
7.39
ALogP
2
HBA
0
HBD
12.5
PSA (Ų)
0.27
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H28BrF2NO
MW 500.43
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -0.60

Data from ChEMBL 36 via Core Engine