InChI key
CPJSUEIXXCENMM-UHFFFAOYSA-N
InChI
1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)
SMILES string
CCOc1ccc(NC(C)=O)cc1
form
powder
storage temp.
2-8°C
mp
133-136 °C
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Biochem/physiol Actions
CYP1A2 和 CYP2D6 的底物。
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Carc. 1B
存储类别
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
法规信息
新产品
此项目有
Mojca Brunskole et al.
Bioorganic & medicinal chemistry, 16(11), 5881-5889 (2008-05-17)
Trihydroxynaphthalene reductase (3HNR) is an essential enzyme in the biosynthesis of fungal melanin and it represents an emerging target for the development of new fungicides and antimicotics. To promote the discovery of new inhibitors, an improved chemical synthesis of the
Huaping Mo et al.
Bioorganic & medicinal chemistry letters, 20(22), 6712-6715 (2010-09-25)
A simple and rapid NMR method is described to determine the logP of pharmaceutical agents. This method is highly versatile and efficient, because it does not require the use of deuterated solvents or the addition of any internal/external standards to
Stanislav Gobec et al.
Bioorganic & medicinal chemistry letters, 15(23), 5170-5175 (2005-09-27)
Nonsteroidal anti-inflammatory drugs (NSAIDs) like indomethacin, flufenamic acid, and related compounds have been recently identified as potent inhibitors of AKR1C3. We report that some other NSAIDs (diclofenac and naproxen) also inhibit AKR1C3, with the IC(50) values in the low micromolar
M Kummu et al.
Placenta, 36(10), 1185-1191 (2015-08-26)
Perfluorinated alkyl acids (PFAAs) are widely used in industry and consumer products. Pregnant women are exposed to PFAAs and their presence in umbilical cord blood represents fetal exposure. Interestingly, PFAAs are substrates for organic anion transporters (OAT) of which OAT4
Haiyan Li et al.
European journal of medicinal chemistry, 44(4), 1600-1606 (2008-09-05)
The first-principle, quantitative structure-hepatic clearance relationship for 50 drugs was constructed based on selected molecular descriptors calculated by TSAR software. The R(2) of the predicted and observed hepatic clearance for the training set (n=36) and test set (n=13) were 0.85
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