| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 18 | Yes |
Popular Name: 2-[2-[4-(aminomethyl)-1-piperidyl]acetyl]-5-methyl-isoxazol-3-one 2-[2-[4-(aminomethyl)-1-piperidy…
| 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) | -0.36 | 4.66 | -113.59 | 4 | 6 | 2 | 84 | 255.318 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.36 | 2.5 | -58.44 | 3 | 6 | 1 | 83 | 254.31 | 3 | ↓ |
