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)
|
0.33 |
-5.04 |
-15.32 |
6 |
10 |
0 |
166 |
434.397 |
4 |
↓
|
Hi
High (pH 8-9.5)
|
0.33 |
-4.05 |
-61.57 |
5 |
10 |
-1 |
169 |
433.389 |
4 |
↓
|
Vendor Notes
Note Type |
Comments |
Provided By |
APPEARANCE |
.; Cream colored powder |
Indofine |
M.P. |
222-224 C |
Indofine |
MP |
222-224o C |
Indofine |
SOLUBILITY |
Soluble in 5 mg/20 ml ethanol |
Indofine |
SOLUBILITY |
Soluble in 5mg/20ml Ethanol |
Indofine |
No pre-computed analogs available. Try a structural similarity search.