| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 20 | Yes |
Popular Name: (2S,4R,5S)-1,2,5-trimethyl-N-[(1S)-1-(p-tolyl)propyl]piperidin-4-amine (2S,4R,5S)-1,2,5-trimethyl-N-[(1…
| 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) | 3.33 | 10.76 | -97.24 | 3 | 2 | 2 | 21 | 276.468 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 10.03 | -31.11 | 2 | 2 | 1 | 16 | 275.46 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.33 | 8.8 | -34.55 | 2 | 2 | 1 | 20 | 275.46 | 4 | ↓ |
