| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 14 | Yes |
Popular Name: (2S)-1-(diethylamino)-3-(3-hydroxypropylamino)propan-2-ol (2S)-1-(diethylamino)-3-(3-hydro…
| 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) | -0.48 | 0 | -101.23 | 5 | 4 | 2 | 61 | 206.33 | 9 | ↓ |
| Hi High (pH 8-9.5) | -0.48 | -1.43 | -34.67 | 4 | 4 | 1 | 57 | 205.322 | 9 | ↓ |
| Mid Mid (pH 6-8) | -0.48 | 0.51 | -43.24 | 4 | 4 | 1 | 64 | 205.322 | 9 | ↓ |
