In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 13 | Yes |
Popular Name: 4-[[(1S)-2-amino-1-methyl-2-oxo-ethyl]-methyl-amino]butanoic 4-[[(1S)-2-amino-1-methyl-2-oxo-…
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) | -0.25 | 2.22 | -56.92 | 3 | 5 | 0 | 88 | 188.227 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.25 | -0.1 | -53.94 | 2 | 5 | -1 | 86 | 187.219 | 6 | ↓ |