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

CHEMBL138284

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
N#CCNC(=O)[C@H](Cc1cccc(C(=N)N)c1)NC(=O)C(c1ccccc1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL138284
Phase Preclinical
Structure Type MOL
InChI Key ZJBCMLOYTLDHGC-QFIPXVFZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

439.5
MW (Da)
2.47
ALogP
4
HBA
4
HBD
131.9
PSA (Ų)
0.23
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 C26H25N5O2
MW 439.52
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.59

Literature References

PubMed DOI Target Context # Activities
11741472 10.1021/jm010206q Cathepsin B 1

Data from ChEMBL 36 via Core Engine