| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 15th, 2009 | 28 | Yes |
Popular Name: 2-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone 2-[(4,5-diphenyl-1,2,4-triazol-3…
| 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) | 3.01 | 10.53 | -12.88 | 0 | 6 | 0 | 54 | 393.516 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.01 | 12.92 | -49.31 | 1 | 6 | 1 | 55 | 394.524 | 5 | ↓ |
