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Analogs
-
36156677
-
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)
|
3.44 |
9.71 |
-53.91 |
3 |
6 |
1 |
80 |
442.605 |
9 |
↓
|
Hi
High (pH 8-9.5)
|
3.89 |
6.91 |
-51.07 |
2 |
6 |
0 |
83 |
441.597 |
9 |
↓
|
|
|
Analogs
-
36156674
-
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)
|
3.44 |
9.34 |
-53.9 |
3 |
6 |
1 |
80 |
442.605 |
9 |
↓
|
Hi
High (pH 8-9.5)
|
3.89 |
6.79 |
-50.7 |
2 |
6 |
0 |
83 |
441.597 |
9 |
↓
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Analogs
-
36158740
-
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)
|
3.41 |
10.07 |
-53.03 |
3 |
6 |
1 |
80 |
440.589 |
10 |
↓
|
Hi
High (pH 8-9.5)
|
3.86 |
7.31 |
-50.02 |
2 |
6 |
0 |
83 |
439.581 |
10 |
↓
|
|
|
Analogs
-
36158735
-
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)
|
3.41 |
9.8 |
-53.46 |
3 |
6 |
1 |
80 |
440.589 |
10 |
↓
|
Hi
High (pH 8-9.5)
|
3.86 |
7.24 |
-44.01 |
2 |
6 |
0 |
83 |
439.581 |
10 |
↓
|
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