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

CHEMBL1180174

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
CCCCCCCCCCCCCCCCOCCSCCOC(=O)N(Cc1cccc[n+]1CC)C(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1180174
Phase Preclinical
Structure Type MOL
InChI Key ARROPNVBRVNBDM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

551.9
MW (Da)
7.71
ALogP
5
HBA
0
HBD
59.7
PSA (Ų)
0.10
QED
2
Ro5 Violations
24
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H55N2O4S+
MW 551.86
Aromatic Rings 1
Heavy Atoms 38
NP-Likeness -0.43

Data from ChEMBL 36 via Core Engine