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Compound Detail

CHEMBL38688

DIPHENYLAMINE
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c1ccc(Nc2ccccc2)cc1

Basic Information

ChEMBL ID CHEMBL38688
Name DIPHENYLAMINE
Phase Preclinical
Structure Type MOL
InChI Key DMBHHRLKUKUOEG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
20
Publications
0
Known Names

Molecular Properties

169.2
MW (Da)
3.43
ALogP
1
HBA
1
HBD
12.0
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C12H11N
MW 169.23
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -0.66

Literature References

PubMed DOI Target Context # Activities
17236778 10.1016/j.bmc.2007.01.007 Erythrocyte 10
6512531 10.1021/np50035a003 Oryctolagus cuniculus 7
17418579 10.1016/j.bmc.2007.03.040 ADMET 6
9154974 10.1021/jm9604989 No relevant target 2
- 10.6019/CHEMBL3301361 No relevant target 2
17418579 10.1016/j.bmc.2007.03.040 Caco-2 2
17418579 10.1016/j.bmc.2007.03.040 No relevant target 1
12699380 10.1021/jm020397c UDP-glucuronosyltransferase 1A4 1
21699136 10.1021/jm200349b RAC-alpha serine/threonine-protein kinase 1
21699136 10.1021/jm200349b RAC-beta serine/threonine-protein kinase 1
21699136 10.1021/jm200349b Mitogen-activated protein kinase kinase kinase 5 1
21699136 10.1021/jm200349b Aurora kinase A 1
21699136 10.1021/jm200349b Aurora kinase B 1
21699136 10.1021/jm200349b Serine/threonine-protein kinase B-raf 1
21699136 10.1021/jm200349b Epidermal growth factor receptor 1
21699136 10.1021/jm200349b Receptor tyrosine-protein kinase erbB-2 1
21699136 10.1021/jm200349b Receptor tyrosine-protein kinase erbB-4 1
21699136 10.1021/jm200349b Focal adhesion kinase 1 1
21699136 10.1021/jm200349b Tyrosine-protein kinase Fes/Fps 1
21699136 10.1021/jm200349b Glycogen synthase kinase-3 beta 1

Data from ChEMBL 36 via Core Engine