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

CHEMBL4860575

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)Oc1ccc(-c2cnc3ccc(-c4ccc5[nH]ccc5c4)cn23)cc1

Basic Information

ChEMBL ID CHEMBL4860575
Phase Preclinical
Structure Type MOL
InChI Key GGZVTOOQQIQCDA-UHFFFAOYSA-N
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

367.4
MW (Da)
5.94
ALogP
3
HBA
1
HBD
42.3
PSA (Ų)
0.43
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H21N3O
MW 367.45
Aromatic Rings 5
Heavy Atoms 28
NP-Likeness -1.04

Activity Summary

EC50 4 meas. best 8.97

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Junin virus
CHEMBL4523072
EC50 8.97 8.97 1.1 1
Machupo mammarenavirus
CHEMBL4888477
EC50 8.77 8.77 1.7 1
Lassa virus
CHEMBL615051
EC50 8.69 8.69 2.0 1
Vesicular stomatitis virus
CHEMBL613739
EC50 5.09 5.09 8120.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
33965007 10.1016/j.bmcl.2021.127983 Lassa virus 1
33965007 10.1016/j.bmcl.2021.127983 Machupo mammarenavirus 1
33965007 10.1016/j.bmcl.2021.127983 Junin virus 1
33965007 10.1016/j.bmcl.2021.127983 Vesicular stomatitis virus 1
33965007 10.1016/j.bmcl.2021.127983 Vero 1

Data from ChEMBL 36 via Core Engine