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Compound Detail

CHEMBL522782

PROCHLORAZ
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CCCN(CCOc1c(Cl)cc(Cl)cc1Cl)C(=O)n1ccnc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL522782
Name PROCHLORAZ
Phase Preclinical
Structure Type MOL
InChI Key TVLSRXXIMLFWEO-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

376.7
MW (Da)
4.60
ALogP
4
HBA
0
HBD
47.4
PSA (Ų)
0.74
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C15H16Cl3N3O2
MW 376.67
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.42

Activity Summary

EC50 1 meas. best 6.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Aryl hydrocarbon receptor
CHEMBL3201
 EC50 6.0 6.0 1000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Aryl hydrocarbon receptor EC50 = 1000.0 nM 6.0 Agonist activity at AhR (unknown origin) 36274276

Literature References

PubMed DOI Target Context # Activities
23073993 10.1002/ps.3408 Oculimacula yallundae 18
22290833 10.1002/ps.2309 Neofusicoccum luteum 14
- 10.1016/j.cropro.2006.06.008 Fusarium odoratissimum 13
- 10.1016/j.cropro.2012.12.009 Monilinia laxa 10
22411894 10.1002/ps.3263 Zymoseptoria tritici 9
- 10.1584/jpestics.27.127 Blumeria graminis f. sp. tritici 7
17620378 10.1128/aac.00654-07 Colletotrichum graminicola 6
22290833 10.1002/ps.2309 Neofusicoccum australe 6
22290833 10.1002/ps.2309 Diplodia mutila 6
27310249 10.1021/acs.jnatprod.6b00252 Molecular identity unknown 5
- 10.1584/jpestics.24.149 Oculimacula yallundae 5
- 10.1584/jpestics.27.127 Podosphaera fuliginea 4
27310249 10.1021/acs.jnatprod.6b00252 NON-PROTEIN TARGET 3
- 10.1584/jpestics.31.14 Alternaria alternata 2
- 10.1584/jpestics.31.14 Fusarium culmorum 2
- 10.1584/jpestics.31.14 Phytophthora cactorum 2
- 10.1016/j.cropro.2011.12.015 Macrophomina phaseolina 2
23073993 10.1002/ps.3408 Unchecked 2
- 10.1016/j.cropro.2006.06.008 Musa acuminata AAA Group 2
- 10.1016/j.cropro.2006.06.008 Fusarium oxysporum 2

Data from ChEMBL 36 via Core Engine