| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: (2S)-1-(ethylamino)-3-[(3-fluorophenyl)methyl-methyl-amino]propan-2-ol (2S)-1-(ethylamino)-3-[(3-fluoro…
| 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 | 2.5 | -40.45 | 3 | 3 | 1 | 40 | 241.33 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 1.15 | -5.03 | 2 | 3 | 0 | 35 | 240.322 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 3.54 | -40.63 | 3 | 3 | 1 | 37 | 241.33 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.05 | 5.44 | -46.26 | 3 | 3 | 1 | 44 | 241.33 | 7 | ↓ |
