| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 12th, 2010 | 16 | Yes |
Popular Name: (2S,3R)-2-amino-N-[2-(dimethylamino)-2-methyl-propyl]-3-methyl-pentanamide (2S,3R)-2-amino-N-[2-(dimethylam…
| 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) | 0.75 | 3.13 | -95.17 | 5 | 4 | 2 | 61 | 231.384 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 1.27 | -62.5 | 4 | 4 | 1 | 67 | 230.376 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.75 | 2.82 | -38.52 | 4 | 4 | 1 | 60 | 230.376 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.93 | 0.83 | -37.51 | 3 | 4 | 0 | 66 | 229.368 | 6 | ↓ |
