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Compound Detail

CHEMBL1449007

2-(2'-METHOXYPHENYL)-1H-INDOLE
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COc1ccccc1-c1cc2ccccc2[nH]1

Basic Information

ChEMBL ID CHEMBL1449007
Name 2-(2'-METHOXYPHENYL)-1H-INDOLE
Phase Preclinical
Structure Type MOL
InChI Key GYUBKMFGRAIVMZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

223.3
MW (Da)
3.84
ALogP
1
HBA
1
HBD
25.0
PSA (Ų)
0.70
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 C15H13NO
MW 223.28
Aromatic Rings 3
Heavy Atoms 17
NP-Likeness -0.49

Activity Summary

IC50 1 meas. best 4.33

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Mitochondrial import inner membrane translocase subunit TIM10
CHEMBL1741194
IC50 4.33 4.33 46900.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
30568753 10.1039/C8MD00436F Unchecked 3
23419325 10.1016/j.bmc.2013.01.032 NON-PROTEIN TARGET 2
23419325 10.1016/j.bmc.2013.01.032 U-87 MG 1
23419325 10.1016/j.bmc.2013.01.032 Unchecked 1
30568753 10.1039/C8MD00436F U-87 MG 1
30568753 10.1039/C8MD00436F U-251 1

Data from ChEMBL 36 via Core Engine