| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2011 | 21 | Yes |
Popular Name: (4-ethyl-4-piperidyl)-[4-(2-methoxyethyl)-1,4-diazepan-1-yl]methanone (4-ethyl-4-piperidyl)-[4-(2-meth…
| 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) | 0.60 | 5.8 | -85.11 | 3 | 5 | 2 | 51 | 299.459 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.60 | 3.88 | -42.7 | 2 | 5 | 1 | 49 | 298.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
