| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 17 | No |
Popular Name: 2-[(3S,5S)-3,5-dimethyl-1-piperidyl]pyridine-3-carbothioamide 2-[(3S,5S)-3,5-dimethyl-1-piperi…
| 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) | 2.52 | 6.79 | -12.89 | 2 | 3 | 0 | 42 | 249.383 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.18 | -44.42 | 3 | 3 | 1 | 43 | 250.391 | 2 | ↓ |
