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)
|
2.49 |
3.65 |
-2.36 |
1 |
1 |
0 |
20 |
152.237 |
1 |
↓
|
Vendor Notes
Note Type |
Comments |
Provided By |
PUBCHEM_PATENT_ID |
EP0269987B1; EP0302424A1; EP0302424B1; EP0321853A1; EP0321853B1 |
IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.