| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 19th, 2008 | 24 | No |
Popular Name: N-(2-diethylaminoethyl)-2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide N-(2-diethylaminoethyl)-2-[3-(p-…
| 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) | 2.63 | 9 | -78.5 | 2 | 6 | 0 | 64 | 347.488 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.63 | 6.68 | -58.27 | 1 | 6 | -1 | 63 | 346.48 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.90 | 9.15 | -54.78 | 3 | 6 | 1 | 67 | 348.496 | 8 | ↓ |
