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

CHEMBL2372385

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
CSCC[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2372385
Phase Preclinical
Structure Type BOTH
InChI Key RBKYMAQIAMFDOE-QYOOZWMWSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

612.8
MW (Da)
0.65
ALogP
7
HBA
6
HBD
185.5
PSA (Ų)
0.14
QED
2
Ro5 Violations
18
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C31H44N6O5S
MW 612.80
Aromatic Rings 2
Heavy Atoms 43
NP-Likeness -0.29

Literature References

PubMed DOI Target Context # Activities
2441057 10.1021/jm00391a046 Adenosine receptor 1
2441057 10.1021/jm00391a046 Substance-P receptor 1

Data from ChEMBL 36 via Core Engine