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Compound Detail

CHEMBL48166

HOMIDIUM
🧪 Phase II
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🧪 Phase II
CC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(N)cc21

Basic Information

ChEMBL ID CHEMBL48166
Name HOMIDIUM
Phase Phase II
Structure Type MOL
InChI Key QTANTQQOYSUMLC-UHFFFAOYSA-O

Known Names

Babidium Ethidium Homidium cation Homidium ion Novidium RD-1572
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
10
Publications
6
Known Names

Molecular Properties

314.4
MW (Da)
4.13
ALogP
2
HBA
2
HBD
55.9
PSA (Ų)
0.33
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -ium

Extended Properties

Molecular Formula C21H20N3+
MW 314.41
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness 0.27

Activity Summary

IC50 4 meas. best 5.75

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Human immunodeficiency virus type 1 reverse transcriptase
CHEMBL247
IC50 5.75 5.6967 1800.0 3
Unchecked
CHEMBL612545
IC50 5.48 5.48 3300.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL4495565 SARS-CoV-2 4
22695131 10.1016/j.bmcl.2012.05.041 Human immunodeficiency virus type 1 reverse transcriptase 3
- 10.6019/CHEMBL4495565 Vero C1008 2
- 10.6019/CHEMBL4495565 ADMET 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
22695131 10.1016/j.bmcl.2012.05.041 Unchecked 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1
38283226 10.1039/d3md00483j Escherichia coli 1
38318365 10.1016/j.isci.2024.108907 Deoxynucleoside triphosphate triphosphohydrolase SAMHD1 1

Data from ChEMBL 36 via Core Engine