| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 26th, 2008 | 24 | No |
Popular Name: (2R)-3-dibenzofuran-3-yl-2-(phosphonomethylamino)propanoic (2R)-3-dibenzofuran-3-yl-2-(phos…
| 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) | 0.02 | 6.94 | -129.57 | 2 | 7 | -2 | 133 | 347.263 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.02 | 5.79 | -53.1 | 3 | 7 | -1 | 130 | 348.271 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ECE1-1-E | Endothelin-converting Enzyme 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 22 | 0.45 | Binding ≤ 10μM |
| NEP-1-E | Neprilysin (cluster #1 Of 2), Eukaryotic | Eukaryotes | 2300 | 0.33 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ECE1_HUMAN | P42892 | Endothelin-converting Enzyme 1, Human | 22 | 0.45 | Binding ≤ 1μM |
| ECE1_HUMAN | P42892 | Endothelin-converting Enzyme 1, Human | 22 | 0.45 | Binding ≤ 10μM |
| NEP_HUMAN | P08473 | Neprilysin, Human | 2300 | 0.33 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Metabolism of Angiotensinogen to Angiotensins |
