In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 15 | No |
Popular Name: (2S)-2-[[2-(cyanomethylamino)-2-oxo-ethyl]-methyl-amino]butanoic (2S)-2-[[2-(cyanomethylamino)-2-…
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) | -1.61 | 3.81 | -43.01 | 2 | 6 | 0 | 97 | 213.237 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.61 | 1.49 | -43.47 | 1 | 6 | -1 | 96 | 212.229 | 6 | ↓ |