| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2008 | 27 | Yes |
Popular Name: (3S)-1-(1-isopropyl-4-piperidyl)-N-[(4-methylsulfanylphenyl)methyl]piperidine-3-carboxamide (3S)-1-(1-isopropyl-4-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) | 3.15 | 9.22 | -41.05 | 2 | 4 | 1 | 37 | 390.617 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 11.72 | -103.22 | 3 | 4 | 2 | 38 | 391.625 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.15 | 9.24 | -38.46 | 2 | 4 | 1 | 37 | 390.617 | 6 | ↓ |
