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

CHEMBL4117845

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
O=C(OCCCCCCCCCCCCCCCC[n+]1cccc2ccccc21)c1ccc(O)cc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117845
Phase Preclinical
Structure Type MOL
InChI Key QCOXZRIGNXQSRV-UHFFFAOYSA-O
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

506.7
MW (Da)
7.86
ALogP
4
HBA
2
HBD
70.6
PSA (Ų)
0.10
QED
2
Ro5 Violations
18
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C32H44NO4+
MW 506.71
Aromatic Rings 3
Heavy Atoms 37
NP-Likeness 0.13

Data from ChEMBL 36 via Core Engine