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

CHEMBL4541946

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
CCCCCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC=C4[C@@H]5CC(C)(C)CC[C@]5(C(=O)NCCCCCC(=O)N[C@H](C(=O)O)C(C)C)CC[C@@]4(C)[C@]3(C)CC[C@H]2C1(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4541946
Phase Preclinical
Structure Type MOL
InChI Key ZVJRSYLLANVZIH-RVUFUUETSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

767.1
MW (Da)
10.18
ALogP
5
HBA
3
HBD
121.8
PSA (Ų)
0.09
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C47H78N2O6
MW 767.15
Aromatic Rings 0
Heavy Atoms 55
NP-Likeness 1.79

Literature References

PubMed DOI Target Context # Activities
31617361 10.1021/acs.jnatprod.9b00649 Protease 1

Data from ChEMBL 36 via Core Engine