bithionol
Identification (Source:EPA,EU)
ID |
512 |
Name |
bithionol |
CAS |
97-18-7 |
IUPAC |
2,2′-thiobis(4,6-dichlorophenol) |
Inchi |
InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H |
CIPAC |
|
EPA Code |
|
Formula |
C12H6Cl4O2S |
SMILES |
Clc(c([H])c(c([H])c1Sc2c([H])c(c([H])c(c2O[H])Cl)Cl)Cl)c1O[H] |
Status |
Not Available |
Classification
Properties (Source:PubChem)
Molecular Weight |
356.05184 |
Physical State |
|
AlogP |
6.122 |
H-Bond Donor |
2 |
H-Bond Acceptor |
3 |
Surface Area |
294.52 |
Polar Surface Area |
65.76 |
Structure
Related targets
Target Name |
RScore (About this table) |
|
Slack
|
98(1,1,2,13) |
Details |
SULT6B1
|
85(1,1,1,5) |
Details |
PARP
|
82(1,1,1,2) |
Details |
IkappaBalpha
|
81(1,1,1,1) |
Details |
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