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)
|
4.20 |
11.89 |
-10.61 |
0 |
4 |
0 |
39 |
351.446 |
5 |
↓
|
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
Z50418-2-O |
Trypanosoma Brucei (cluster #2 Of 6), Other |
Other |
41 |
0.40 |
Functional ≤ 10μM
|
Z50725-1-O |
Trypanosoma Brucei Rhodesiense (cluster #1 Of 7), Other |
Other |
11 |
0.43 |
Functional ≤ 10μM
|
No pre-computed analogs available. Try a structural similarity search.