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

CHEMBL1186512

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
CCCCCCN1/C(=C/C=C/c2sc3ccccc3[n+]2CCCCCC)Sc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186512
Phase Preclinical
Structure Type MOL
InChI Key JLASFSWVPRDVNS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

477.8
MW (Da)
8.82
ALogP
3
HBA
0
HBD
7.1
PSA (Ų)
0.19
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H37N2S2+
MW 477.76
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.75

Data from ChEMBL 36 via Core Engine