| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 15 | Yes |
Popular Name: (2S)-N',2-dimethyl-N'-[2-(2-methylimidazol-1-yl)ethyl]propane-1,3-diamine (2S)-N',2-dimethyl-N'-[2-(2-meth…
| 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) | -0.34 | 3.31 | -48.61 | 3 | 4 | 1 | 49 | 211.333 | 6 | ↓ |
| Hi High (pH 8-9.5) | -0.34 | 4.98 | -46.71 | 3 | 4 | 1 | 48 | 211.333 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.34 | 5.35 | -116.96 | 4 | 4 | 2 | 50 | 212.341 | 6 | ↓ |
| Mid Mid (pH 6-8) | -0.34 | 3.78 | -80.21 | 4 | 4 | 2 | 50 | 212.341 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -0.34 | 5.82 | -174.31 | 5 | 4 | 3 | 51 | 213.349 | 6 | ↓ |
