| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 16 | Yes |
Popular Name: (2R)-N2-methyl-N2-[(2S)-2-methylbutyl]octane-1,2-diamine (2R)-N2-methyl-N2-[(2S)-2-methyl…
| 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) | 3.71 | 6.67 | -42.25 | 3 | 2 | 1 | 31 | 229.432 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 7.71 | -30.05 | 3 | 2 | 1 | 30 | 229.432 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.71 | 8.08 | -118.78 | 4 | 2 | 2 | 32 | 230.44 | 10 | ↓ |
