| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 17 | Yes |
Popular Name: (2S)-N2-ethyl-2-methyl-N2-[(1S)-1-methylpropyl]octane-1,2-diamine (2S)-N2-ethyl-2-methyl-N2-[(1S)-…
| 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) | 4.12 | 6.22 | -41.09 | 3 | 2 | 1 | 31 | 243.459 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 7.73 | -24.72 | 3 | 2 | 1 | 30 | 243.459 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.12 | 8.04 | -109.75 | 4 | 2 | 2 | 32 | 244.467 | 10 | ↓ |
