| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2010 | 18 | Yes |
Popular Name: (3S,4R)-3-methyl-1-[(5-methylisoxazol-3-yl)methyl]-N-propyl-piperidin-4-amine (3S,4R)-3-methyl-1-[(5-methyliso…
| 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) | 2.21 | 5.4 | -42.48 | 2 | 4 | 1 | 46 | 252.382 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.22 | 6.25 | -38.39 | 2 | 4 | 1 | 42 | 252.382 | 5 | ↓ |
