| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2010 | 31 | Yes |
Popular Name: 4-(1-phenyl-2-(3-phenylureido)ethoxy)benzo[b]thiophene-2-carboximidamide 4-(1-phenyl-2-(3-phenylureido)et…
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CAS Number: 1057337-39-9
| 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) | 4.25 | 8.39 | -38.54 | 6 | 6 | 1 | 102 | 431.541 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FA10-1-E | Coagulation Factor X (cluster #1 Of 2), Eukaryotic | Eukaryotes | 960 | 0.27 | Binding ≤ 10μM |
| FA9-1-E | Coagulation Factor IX (cluster #1 Of 1), Eukaryotic | Eukaryotes | 29 | 0.34 | Binding ≤ 10μM |
| UROK-2-E | Urokinase-type Plasminogen Activator (cluster #2 Of 4), Eukaryotic | Eukaryotes | 250 | 0.30 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FA9_HUMAN | P00740 | Coagulation Factor IX, Human | 29 | 0.34 | Binding ≤ 1μM |
| FA10_HUMAN | P00742 | Coagulation Factor X, Human | 960 | 0.27 | Binding ≤ 1μM |
| UROK_HUMAN | P00749 | Urokinase-type Plasminogen Activator, Human | 250 | 0.30 | Binding ≤ 1μM |
| FA9_HUMAN | P00740 | Coagulation Factor IX, Human | 29 | 0.34 | Binding ≤ 10μM |
| FA10_HUMAN | P00742 | Coagulation Factor X, Human | 960 | 0.27 | Binding ≤ 10μM |
| UROK_HUMAN | P00749 | Urokinase-type Plasminogen Activator, Human | 250 | 0.30 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Common Pathway | |
| Dissolution of Fibrin Clot | |
| Extrinsic Pathway | |
| Gamma-carboxylation of protein precursors | |
| Intrinsic Pathway | |
| Removal of aminoterminal propeptides from gamma-carboxylated proteins | |
| Transport of gamma-carboxylated protein precursors from the endoplasmic reticulu |
No pre-computed analogs available. Try a structural similarity search.