| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-N'-ethyl-2-methyl-N'-[2-(2-methylimidazol-1-yl)ethyl]propane-1,3-diamine (2S)-N'-ethyl-2-methyl-N'-[2-(2-…
| 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) | 0.04 | 3.84 | -48.53 | 3 | 4 | 1 | 49 | 225.36 | 7 | ↓ |
| Hi High (pH 8-9.5) | 0.04 | 5.62 | -44.91 | 3 | 4 | 1 | 48 | 225.36 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.04 | 6 | -118.98 | 4 | 4 | 2 | 50 | 226.368 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.04 | 4.3 | -80.19 | 4 | 4 | 2 | 50 | 226.368 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.04 | 6.48 | -178.37 | 5 | 4 | 3 | 51 | 227.376 | 7 | ↓ |
