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

CHEMBL2030171

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
CCOc1ccc(NC(=S)N2CCC(C(c3ccccc3)c3ccccc3)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2030171
Phase Preclinical
Structure Type MOL
InChI Key WWMUGAUNVCWXCT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

430.6
MW (Da)
6.33
ALogP
2
HBA
1
HBD
24.5
PSA (Ų)
0.46
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H30N2OS
MW 430.62
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness -1.03

Literature References

PubMed DOI Target Context # Activities
22607676 10.1016/j.bmcl.2012.04.107 Neuropeptide Y receptor type 2 1
22607676 10.1016/j.bmcl.2012.04.107 Neuropeptide Y receptor type 1 1

Data from ChEMBL 36 via Core Engine