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

CHEMBL1184272

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
CCOC1(OCC)C2c3c(Br)cccc3C([n+]3ccccc32)C1(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184272
Phase Preclinical
Structure Type MOL
InChI Key VSBDNMJNZDGYRX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

403.3
MW (Da)
4.58
ALogP
2
HBA
0
HBD
22.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H25BrNO2+
MW 403.34
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness 0.18

Data from ChEMBL 36 via Core Engine