| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 13 | Yes |
Popular Name: (2S)-1-[butyl(methyl)amino]-3-(ethylamino)propan-2-ol (2S)-1-[butyl(methyl)amino]-3-(e…
| 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) | 0.95 | 3.4 | -98.48 | 4 | 3 | 2 | 41 | 190.331 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 3.95 | -40.56 | 3 | 3 | 1 | 44 | 189.323 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.95 | 1.98 | -34.22 | 3 | 3 | 1 | 37 | 189.323 | 8 | ↓ |
