| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 14 | Yes |
Popular Name: (2S)-1-amino-3-[2-dimethylaminoethyl(propyl)amino]propan-2-ol (2S)-1-amino-3-[2-dimethylaminoe…
| 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) | -0.59 | 1.87 | -191.92 | 6 | 4 | 3 | 57 | 206.354 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | 2.42 | -107.04 | 5 | 4 | 2 | 60 | 205.346 | 8 | ↓ |
| Hi High (pH 8-9.5) | -0.59 | -0.75 | -33.85 | 4 | 4 | 1 | 54 | 204.338 | 8 | ↓ |
| Mid Mid (pH 6-8) | -0.59 | -0.28 | -91.75 | 5 | 4 | 2 | 56 | 205.346 | 8 | ↓ |
