| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 18th, 2008 | 26 | No |
Popular Name: N-[2-(diisopropylamino)ethyl]-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-[2-(diisopropylamino)ethyl]-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) | 3.22 | 9.59 | -74.82 | 2 | 6 | 0 | 64 | 375.542 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.22 | 7.55 | -59.07 | 1 | 6 | -1 | 63 | 374.534 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.49 | 9.75 | -51.68 | 3 | 6 | 1 | 67 | 376.55 | 8 | ↓ |
