In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 9th, 2010 | 14 | No |
Popular Name: (2R)-2-amino-4-(4-hydroxy-4-oxo-butyl)sulfanyl-butanoic (2R)-2-amino-4-(4-hydroxy-4-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) | -2.45 | 4.65 | -81.46 | 3 | 5 | -1 | 108 | 220.27 | 8 | ↓ |
Hi High (pH 8-9.5) | -2.45 | 4.33 | -95.38 | 2 | 5 | -2 | 106 | 219.262 | 8 | ↓ |