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)
|
-0.91 |
-4.34 |
-17.02 |
5 |
10 |
0 |
149 |
311.298 |
4 |
↓
|
|
Lo
Low (pH 4.5-6)
|
-0.91 |
-3.43 |
-35.11 |
6 |
10 |
1 |
150 |
312.306 |
4 |
↓
|
Vendor Notes
| Note Type |
Comments |
Provided By |
| Boiling_Point |
n.d. |
Squarix |
No pre-computed analogs available. Try a structural similarity search.
