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)
|
2.31 |
6.09 |
-9.46 |
1 |
3 |
0 |
38 |
191.259 |
2 |
↓
|
|
Lo
Low (pH 4.5-6)
|
2.31 |
6.6 |
-25.83 |
2 |
3 |
1 |
39 |
192.267 |
2 |
↓
|
Clustered Target Annotations
| Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
|
VGFR2-2-E |
Vascular Endothelial Growth Factor Receptor 2 (cluster #2 Of 2), Eukaryotic |
Eukaryotes |
1274 |
0.63 |
Binding ≤ 10μM
|
ChEMBL Target Annotations
| Uniprot |
Swissprot |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
|
VGFR2_HUMAN |
P35968
|
Vascular Endothelial Growth Factor Receptor 2, Human |
1274 |
0.63 |
Binding ≤ 10μM
|
Reactome Annotations from Targets (via Uniprot)
| Description |
Species |
|
EPHA-mediated growth cone collapse |
|
|
Integrin cell surface interactions |
|
|
Neurophilin interactions with VEGF and VEGFR |
|
|
VEGF binds to VEGFR leading to receptor dimerization |
|
|
VEGFA-VEGFR2 Pathway |
|
|
VEGFR2 mediated cell proliferation |
|
No pre-computed analogs available. Try a structural similarity search.
