| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 16 | Yes |
Popular Name: (2S,3R)-N2-methyl-N2-[(1R)-1-methylbutyl]-N3-propyl-pentane-2,3-diamine (2S,3R)-N2-methyl-N2-[(1R)-1-met…
| 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) | 3.97 | 8.5 | -99.98 | 3 | 2 | 2 | 21 | 230.44 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.97 | 5.76 | -33.79 | 2 | 2 | 1 | 20 | 229.432 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.97 | 7.37 | -28.5 | 2 | 2 | 1 | 16 | 229.432 | 9 | ↓ |
