| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2009 | 15 | Yes |
Popular Name: (2S)-1-[methyl(pentyl)amino]-3-(propylamino)propan-2-ol (2S)-1-[methyl(pentyl)amino]-3-(…
| 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) | 1.95 | 4.94 | -100.75 | 4 | 3 | 2 | 41 | 218.385 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 5.48 | -41.15 | 3 | 3 | 1 | 44 | 217.377 | 10 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 3.52 | -34.61 | 3 | 3 | 1 | 37 | 217.377 | 10 | ↓ |
