| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2011 | 21 | Yes |
Popular Name: 1-[2-[4-(2-dimethylaminoethyl)piperazin-1-yl]ethyl]triazole-4-carboxylic 1-[2-[4-(2-dimethylaminoethyl)pi…
| 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) | -0.38 | 4.98 | -118.83 | 2 | 8 | 1 | 83 | 297.383 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.38 | 0.23 | -49.29 | 0 | 8 | -1 | 81 | 295.367 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.38 | 2.72 | -75.67 | 1 | 8 | 0 | 82 | 296.375 | 7 | ↓ |
