| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 12 | Yes |
Popular Name: (2S)-3-[(2-hydroxy-2-methyl-propyl)-methyl-amino]-2-methyl-propanenitrile (2S)-3-[(2-hydroxy-2-methyl-prop…
| 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) | 1.05 | 2.27 | -5.43 | 1 | 3 | 0 | 47 | 170.256 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 3.85 | -44.79 | 2 | 3 | 1 | 48 | 171.264 | 4 | ↓ |
