| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2009 | 11 | Yes |
Popular Name: (2S)-N2-methyl-N2-[(1R)-1-methylbutyl]propane-1,2-diamine (2S)-N2-methyl-N2-[(1R)-1-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) | 1.25 | 2.48 | -39.1 | 3 | 2 | 1 | 31 | 159.297 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 3.86 | -112.93 | 4 | 2 | 2 | 32 | 160.305 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.25 | 3.47 | -28.08 | 3 | 2 | 1 | 30 | 159.297 | 5 | ↓ |
