| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2004 | 12 | Yes |
Popular Name: [(1S,2S)-3-tert-butoxy-2-hydroxy-3-keto-1-methyl-propyl]ammonium [(1S,2S)-3-tert-butoxy-2-hydroxy…
| 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) | -0.08 | 0.66 | -46.1 | 4 | 4 | 1 | 74 | 176.236 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.08 | 0.42 | -4.78 | 3 | 4 | 0 | 73 | 175.228 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.08 | 1.25 | -40.07 | 3 | 4 | 0 | 77 | 175.228 | 4 | ↓ |
