| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 17 | Yes |
Popular Name: 1-[(3S,6S)-6-methyl-3-piperidyl]-4-methylsulfonyl-piperazine 1-[(3S,6S)-6-methyl-3-piperidyl]…
| 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) | 0.11 | 0.05 | -41.93 | 2 | 5 | 1 | 57 | 262.399 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.11 | -1.21 | -9.43 | 1 | 5 | 0 | 53 | 261.391 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
