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Analogs
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41586198
-
Draw
Identity
99%
90%
80%
70%
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
3.58 |
10.88 |
-51.99 |
2 |
7 |
1 |
94 |
412.462 |
6 |
↓
|
Hi
High (pH 8-9.5)
|
3.58 |
8.61 |
-13.47 |
1 |
7 |
0 |
93 |
411.454 |
6 |
↓
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Mid
Mid (pH 6-8)
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3.58 |
11.64 |
-38.65 |
1 |
7 |
0 |
97 |
411.454 |
6 |
↓
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Analogs
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41586178
-
Draw
Identity
99%
90%
80%
70%
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
3.80 |
11.7 |
-52.24 |
2 |
7 |
1 |
94 |
426.489 |
6 |
↓
|
Hi
High (pH 8-9.5)
|
3.80 |
9.44 |
-14 |
1 |
7 |
0 |
93 |
425.481 |
6 |
↓
|
Mid
Mid (pH 6-8)
|
3.80 |
12.46 |
-39.15 |
1 |
7 |
0 |
97 |
425.481 |
6 |
↓
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Analogs
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41586252
-
Draw
Identity
99%
90%
80%
70%
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
3.20 |
10.28 |
-52.46 |
2 |
7 |
1 |
94 |
398.435 |
6 |
↓
|
Hi
High (pH 8-9.5)
|
3.20 |
8.78 |
-48.79 |
0 |
7 |
-1 |
96 |
396.419 |
6 |
↓
|
Mid
Mid (pH 6-8)
|
3.20 |
8.02 |
-13.7 |
1 |
7 |
0 |
93 |
397.427 |
6 |
↓
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Analogs
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41586231
-
Draw
Identity
99%
90%
80%
70%
Physical Representations
Type
pH range
|
xlogP
|
Des A‑Pol
Apolar desolvation
(kcal/mol)
|
Des Pol
Polar desolvation
(kcal/mol)
|
H Don
H-bond donors
|
H Acc
H-bond acceptors
|
Chg
Net charge
|
tPSA
(Ų)
|
MWT
Molecular weight
(g/mol)
|
RB
Rotatable bonds
|
DL |
Ref
Reference (pH 7)
|
3.42 |
11.1 |
-52.83 |
2 |
7 |
1 |
94 |
412.462 |
6 |
↓
|
Hi
High (pH 8-9.5)
|
3.42 |
9.61 |
-49.6 |
0 |
7 |
-1 |
96 |
410.446 |
6 |
↓
|
Mid
Mid (pH 6-8)
|
3.42 |
8.84 |
-14.21 |
1 |
7 |
0 |
93 |
411.454 |
6 |
↓
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