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)
|
-0.99 |
-5.96 |
-22.52 |
6 |
11 |
0 |
169 |
339.308 |
5 |
↓
|
Vendor Notes
Note Type |
Comments |
Provided By |
PUBCHEM_PATENT_ID |
EP0341065A2; EP0341065B1; EP0961775A2; US5011828; US5136030 |
IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.