| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 15 | Yes |
Popular Name: (2S)-2-amino-3-[methyl-[(1R)-1-(2-thienyl)ethyl]amino]propanoic (2S)-2-amino-3-[methyl-[(1R)-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) | -1.15 | 2.7 | -31.98 | 3 | 4 | 0 | 71 | 228.317 | 5 | ↓ |
| Hi High (pH 8-9.5) | -1.15 | 2.08 | -41.44 | 2 | 4 | -1 | 69 | 227.309 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.15 | 4.58 | -39.65 | 3 | 4 | 0 | 71 | 228.317 | 5 | ↓ |
| Mid Mid (pH 6-8) | -1.15 | 4.9 | -70.28 | 4 | 4 | 1 | 72 | 229.325 | 5 | ↓ |
