| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | Yes |
Popular Name: 1-[2-[methyl-[2-(methylamino)ethyl]amino]ethyl]triazole-4-carboxylic 1-[2-[methyl-[2-(methylamino)eth…
| 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) | -0.52 | 1.17 | -76.46 | 2 | 7 | 0 | 91 | 227.268 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | -0.28 | -49.22 | 1 | 7 | -1 | 86 | 226.26 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.52 | 2.05 | -73.5 | 2 | 7 | 0 | 87 | 227.268 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.52 | 3.47 | -139.84 | 3 | 7 | 1 | 92 | 228.276 | 7 | ↓ |
