| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 17 | Yes |
Popular Name: [(3S)-3-ethyl-3-piperidyl]-(4-methylpiperazin-1-yl)methanone [(3S)-3-ethyl-3-piperidyl]-(4-me…
| 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) | 0.34 | 2.43 | -43.41 | 2 | 4 | 1 | 40 | 240.371 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.34 | 4.81 | -107.31 | 3 | 4 | 2 | 41 | 241.379 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
