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

CHEMBL250319

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
COc1ccc2nc(NCCCCNCc3ccsc3)cc(C)c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL250319
Phase Preclinical
Structure Type MOL
InChI Key UBLPMASNMRLCGE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

355.5
MW (Da)
4.60
ALogP
5
HBA
2
HBD
46.2
PSA (Ų)
0.55
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H25N3OS
MW 355.51
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.69

Literature References

PubMed DOI Target Context # Activities
17532215 10.1016/j.bmcl.2007.05.034 Melanin-concentrating hormone receptor 1 1

Data from ChEMBL 36 via Core Engine