| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 23rd, 2005 | 13 | Yes |
Popular Name: 2-ethyladamantan-2-amine 2-ethyladamantan-2-amine
| 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) | 3.44 | -1.33 | -39.51 | 3 | 1 | 1 | 27 | 180.315 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z101821-2-O | H2N2 Subtype (cluster #2 Of 3), Other | Other | 1900 | 0.62 | Functional ≤ 10μM |
| Z50652-2-O | Influenza A Virus (cluster #2 Of 4), Other | Other | 1900 | 0.62 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z101821 | Z101821 | H2N2 Subtype | 1900 | 0.62 | Functional ≤ 10μM |
| Z50652 | Z50652 | Influenza A Virus | 1900 | 0.62 | Functional ≤ 10μM |
