| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 16 | Yes |
Popular Name: (2S)-1-(ethylamino)-3-[methyl(2-pyridylmethyl)amino]propan-2-ol (2S)-1-(ethylamino)-3-[methyl(2-…
| 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) | -0.26 | 0.56 | -40.1 | 3 | 4 | 1 | 53 | 224.328 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.26 | -0.81 | -6.2 | 2 | 4 | 0 | 48 | 223.32 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.26 | 1.6 | -36.07 | 3 | 4 | 1 | 50 | 224.328 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.26 | 1.28 | -80.25 | 4 | 4 | 2 | 54 | 225.336 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.26 | 3.51 | -45.29 | 3 | 4 | 1 | 57 | 224.328 | 7 | ↓ |
