Chemistry Reference
In-Depth Information
TABLE 5.4 (
Continued
)
QSARs from 2004-2011 References
Reference
Endpoint
QSAR
Chen and Wang (2007)
Ag
+
, Cd
2+
, Co
2+
, Cr
3+,
Cs
+
, Cu
2+
, Ni
2
+
, Pb
2+
, Sr
2+
,
Zn
2+
biosorption to
S. cerevisae
( )
qmax = −0.127 + 0.023(Z*)
qmax = 0.47 - 14.9(AR/AW)
qmax = 0.029 + 0.061
X
r
m
Cd
2+
, Co
2+
, Cr
3+
, Cu
2+
, Ni
2
+
, Pb
2+
, Sr
2+
, Zn
2+
biosorption to
S. cerevisae
qmax = −0.026 + 0.005(AN)
qmax = 0.029 + 0.061
X
r
m
( )
qmax = 0.039 + 0. 026(AN/ΔIP)
qmax = 0.002 + 0. 002(AW)
qmax = 0.457 − 15.56(AR/AW)
qmax = −0.024 + 0.028(Z*)
qmax = −0.018 + 0.05
X
r
m
2
(
)
- 0.01(AN/ΔIP)
Kinraide and Yermiyahu
(2007)
Binding strength
log
a
PM,M
= 1.60 - 2.41 exp [0.238(Scale values)]
Walker et al. (2007)
Toxicity to sunflower seeds (
Helianthus annuus
F.1.
“Sunspot”)
−(log EC
50
) = 0.756 + 0.000140 ρ
−(log EC
50
) = 0.534 + 0.000157 ρ − 0.00166 ΔH
s
−(log EC
50
) = 0.636 + 0.000209 ρ − 0.00367 ΔH
s
− 0.242 log K
1
(sulphate)
−(log EC
50
) = 1.17 − 0.254 log M
soil
−(log EC
50
) = 0.916 − 0.337 log M
soil
+ 0.000014 mg X/kg soil
−(log EC
50
) = 1.04 − 0.302 log M
soil
+ 0.000013 mg X/kg soil − 0.000025 Land plants
Van Kolck et al. (2008)
Bioconcentration Factor (BCF) for the mussel,
Mytilus edulis
2
Log BCF = 2.0 + 0.1 log|
K
OH
|
Log BCF = 2.8 + 0.1 σ
p
Log BCF = 1.4 - 0.5
X
r
m
