| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 16 | Yes |
Popular Name: (2S)-N2-[(1R)-1,3-dimethylbutyl]-N2,2,4-trimethyl-pentane-1,2-diamine (2S)-N2-[(1R)-1,3-dimethylbutyl]…
| 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) | 3.22 | 5.18 | -40.4 | 3 | 2 | 1 | 31 | 229.432 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 6.05 | -27.31 | 3 | 2 | 1 | 30 | 229.432 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 6.34 | -112.85 | 4 | 2 | 2 | 32 | 230.44 | 7 | ↓ |
