| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 30 | Yes |
Popular Name: (2S,3R)-3-hydroxy-2-[(hydroxy-methoxy-methyl-BLAHyl)amino]butanoic (2S,3R)-3-hydroxy-2-[(hydroxy-me…
| 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) | -0.80 | 3.04 | -102.06 | 5 | 8 | 1 | 120 | 419.498 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 1.34 | -55.78 | 3 | 8 | -1 | 114 | 417.482 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.80 | 2.99 | -87.98 | 4 | 8 | 0 | 116 | 418.49 | 5 | ↓ |
| Mid Mid (pH 6-8) | -0.80 | 1.53 | -39.81 | 4 | 8 | 0 | 119 | 418.49 | 5 | ↓ |
