| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 18th, 2006 | 30 | Yes |
Popular Name: N-[2-(2,6-dimethyl-1-piperidyl)ethyl]-phenyl-BLAHamine N-[2-(2,6-dimethyl-1-piperidyl)e…
| 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) | 5.06 | -0.29 | -39.44 | 2 | 6 | 1 | 59 | 401.538 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50600-1-O | Vaccinia Virus (cluster #1 Of 2), Other | Other | 7300 | 0.24 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50600 | Z50600 | Vaccinia Virus | 7300 | 0.24 | Functional ≤ 10μM |
