| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 17 | Yes |
Popular Name: (2S)-N1,N1-diethyl-N2-[2-(2-methylimidazol-1-yl)ethyl]propane-1,2-diamine (2S)-N1,N1-diethyl-N2-[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) | 0.98 | 6.03 | -45.98 | 2 | 4 | 1 | 38 | 239.387 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 6.87 | -41.32 | 2 | 4 | 1 | 34 | 239.387 | 8 | ↓ |
| Hi High (pH 8-9.5) | 0.98 | 4.95 | -5.34 | 1 | 4 | 0 | 33 | 238.379 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 8.13 | -127.97 | 3 | 4 | 2 | 39 | 240.395 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 7.36 | -80.47 | 3 | 4 | 2 | 36 | 240.395 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 6.85 | -93.88 | 3 | 4 | 2 | 39 | 240.395 | 8 | ↓ |
| Mid Mid (pH 6-8) | 0.98 | 8.53 | -192.19 | 4 | 4 | 3 | 40 | 241.403 | 8 | ↓ |
