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About This Item
Linear Formula:
C6H5NHC6H4NH2
CAS Number:
Molecular Weight:
184.24
EC Number:
202-951-9
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
908935
MDL number:
grade
technical
assay
≥98.0% (NT)
mp
68-72 °C
SMILES string
Nc1ccc(Nc2ccccc2)cc1
InChI
1S/C12H12N2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,14H,13H2
InChI key
ATGUVEKSASEFFO-UHFFFAOYSA-N
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Aquatic Chronic 2 - Eye Irrit. 2 - Skin Sens. 1
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
390.2 °F
flash_point_c
199 °C
ppe
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Regulatory Information
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Ute F Röhrig et al.
Journal of medicinal chemistry, 53(3), 1172-1189 (2010-01-09)
Indoleamine 2,3-dioxygenase (IDO) is an important therapeutic target for the treatment of diseases such as cancer that involve pathological immune escape. We have used the evolutionary docking algorithm EADock to design new inhibitors of this enzyme. First, we investigated the
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 233560-5G | 04061832853031 |
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