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)
|
-0.40 |
7.42 |
-75.9 |
7 |
9 |
1 |
158 |
462.596 |
10 |
↓
|
Hi
High (pH 8-9.5)
|
-0.40 |
6.15 |
-90.21 |
6 |
9 |
0 |
153 |
461.588 |
10 |
↓
|
Clustered Target Annotations
Code |
Organism Class |
Affinity (nM) |
LE (kcal/mol/atom) |
Type |
THRB-1-E |
Prothrombin (cluster #1 Of 8), Eukaryotic |
Eukaryotes |
3 |
0.37 |
Binding ≤ 10μM
|
Reactome Annotations from Targets (via Uniprot)
Description |
Species |
Cell surface interactions at the vascular wall |
|
Common Pathway |
|
G alpha (q) signalling events |
|
Gamma-carboxylation of protein precursors |
|
Intrinsic Pathway |
|
Peptide ligand-binding receptors |
|
Platelet Aggregation (Plug Formation) |
|
Regulation of Insulin-like Growth Factor (IGF) transport and uptake by Insulin-l |
|
Removal of aminoterminal propeptides from gamma-carboxylated proteins |
|
Thrombin signalling through proteinase activated receptors (PARs) |
|
Transport of gamma-carboxylated protein precursors from the endoplasmic reticulu |
|
No pre-computed analogs available. Try a structural similarity search.