In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 16 | Yes |
Popular Name: (2S)-2-[3-[ethyl(2-hydroxyethyl)amino]propanoylamino]propanoic (2S)-2-[3-[ethyl(2-hydroxyethyl)…
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) | -2.42 | 0.81 | -60.36 | 3 | 6 | 0 | 94 | 232.28 | 8 | ↓ |
Hi High (pH 8-9.5) | -2.42 | -1.52 | -46.96 | 2 | 6 | -1 | 93 | 231.272 | 8 | ↓ |