| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2009 | 15 | Yes |
Popular Name: (2S)-2-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethylamino]butan-1-ol (2S)-2-[2-[(2S)-2-(hydroxymethyl…
| 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) | 0.12 | -1.11 | -32.68 | 4 | 4 | 1 | 57 | 217.333 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.12 | -1.84 | -35.15 | 4 | 4 | 1 | 60 | 217.333 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.12 | 0.18 | -107.48 | 5 | 4 | 2 | 61 | 218.341 | 7 | ↓ |
