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

CHEMBL1185891

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
CCN1/C(=C/C=c2\s/c(=C\C3=[N+](CC)CCS3)n(CC)c2=O)C=Cc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185891
Phase Preclinical
Structure Type MOL
InChI Key WVKFOKPECHHTBW-PVAQLMIFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

438.6
MW (Da)
3.11
ALogP
5
HBA
0
HBD
28.2
PSA (Ų)
0.67
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H28N3OS2+
MW 438.64
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.45

Data from ChEMBL 36 via Core Engine