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Compound Detail

CHEMBL81880

ACRIDINE ORANGE
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CN(C)c1ccc2cc3ccc(N(C)C)cc3nc2c1

Basic Information

ChEMBL ID CHEMBL81880
Name ACRIDINE ORANGE
Phase Preclinical
Structure Type MOL
InChI Key DPKHZNPWBDQZCN-UHFFFAOYSA-N
2
Targets
5
Activities
1
Assay Types
0
PK Parameters
12
Publications
0
Known Names

Molecular Properties

265.4
MW (Da)
3.52
ALogP
3
HBA
0
HBD
19.4
PSA (Ų)
0.66
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H19N3
MW 265.36
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.68

Activity Summary

IC50 5 meas. best 6.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Amyloid-beta precursor protein
CHEMBL2487
IC50 6.22 6.22 600.0 1
Telomerase reverse transcriptase
CHEMBL2916
IC50 4.91 4.91 12200.0 3

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
18694955 10.1128/aac.00661-08 NON-PROTEIN TARGET 7
18725450 10.1128/aac.00245-08 Pasteurella multocida 7
18268083 10.1128/aac.01052-07 NON-PROTEIN TARGET 6
7265110 10.1021/jm00135a003 Rattus norvegicus 5
18268083 10.1128/aac.01052-07 Escherichia coli 4
19770280 10.1128/aac.00748-09 Acinetobacter baumannii 4
11591511 10.1016/s0960-894x(01)00553-4 Telomerase reverse transcriptase 3
19770280 10.1128/aac.00748-09 Escherichia coli 3
17270435 10.1016/j.bmcl.2006.10.090 Amyloid-beta precursor protein 1
22695131 10.1016/j.bmcl.2012.05.041 Human immunodeficiency virus type 1 reverse transcriptase 1
23122936 10.1016/j.bmc.2012.09.068 Nucleic Acid 1
37406384 10.1016/j.ejmech.2023.115598 Calf thymus DNA 1

Data from ChEMBL 36 via Core Engine