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)
|
5.13 |
10.9 |
-46.44 |
2 |
6 |
1 |
59 |
471.503 |
7 |
↓
|
Mid
Mid (pH 6-8)
|
5.13 |
8.6 |
-15.65 |
1 |
6 |
0 |
58 |
470.495 |
7 |
↓
|
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
MCHR1-2-E |
Melanin-concentrating Hormone Receptor 1 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
346 |
0.27 |
Binding ≤ 10μM
|
Reactome Annotations from Targets (via Uniprot)
Description |
Species |
G alpha (i) signalling events |
|
G alpha (q) signalling events |
|
Peptide ligand-binding receptors |
|
No pre-computed analogs available. Try a structural similarity search.