In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2010 | 15 | Yes |
Popular Name: (2S)-2-[methyl(piperazine-1-carbonyl)amino]propanoic (2S)-2-[methyl(piperazine-1-carb…
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) | -2.35 | 3.11 | -78.76 | 2 | 6 | 0 | 80 | 215.253 | 2 | ↓ |
Mid Mid (pH 6-8) | -2.35 | 1.73 | -49.85 | 1 | 6 | -1 | 76 | 214.245 | 2 | ↓ |