| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 15 | Yes |
Popular Name: (2S)-1-(methylamino)-3-[methyl(4-pyridylmethyl)amino]propan-2-ol (2S)-1-(methylamino)-3-[methyl(4…
| 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) | -0.41 | -0.23 | -42.33 | 3 | 4 | 1 | 53 | 210.301 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.41 | -1.68 | -5.88 | 2 | 4 | 0 | 48 | 209.293 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.41 | 0.76 | -42.82 | 3 | 4 | 1 | 50 | 210.301 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.41 | 2.73 | -48.49 | 3 | 4 | 1 | 57 | 210.301 | 6 | ↓ |
