| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-3-[4-(dimethylaminomethyl)-1-piperidyl]propanoic (2S)-2-amino-3-[4-(dimethylamino…
None
| 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) | -2.20 | 5.23 | -86.27 | 4 | 5 | 1 | 75 | 230.332 | 5 | ↓ |
| Hi High (pH 8-9.5) | -2.20 | 3.13 | -44.43 | 3 | 5 | 0 | 74 | 229.324 | 5 | ↓ |
| Mid Mid (pH 6-8) | -2.20 | 3.68 | -72.88 | 4 | 5 | 1 | 75 | 230.332 | 5 | ↓ |
| Mid Mid (pH 6-8) | -2.20 | 5.61 | -146.71 | 5 | 5 | 2 | 77 | 231.34 | 5 | ↓ |
