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

CHEMBL353782

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
CC(C)[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H](C(N)=O)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL353782
Phase Preclinical
Structure Type MOL
InChI Key HQJDPWUHNHPHKG-CQJMVLFOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

517.6
MW (Da)
1.74
ALogP
6
HBA
5
HBD
146.4
PSA (Ų)
0.23
QED
1
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H35N5O4
MW 517.63
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -0.40

Literature References

PubMed DOI Target Context # Activities
12593654 10.1021/jm020951i Plasmepsin I 1
12593654 10.1021/jm020951i Plasmepsin II 1
12593654 10.1021/jm020951i Cathepsin D 1

Data from ChEMBL 36 via Core Engine