| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2006 | 30 | Yes |
Popular Name: 1-[[5-phenacylsulfanyl-4-(2-pyridyl)-1,2,4-triazol-3-yl]methyl]azepan-2-one 1-[[5-phenacylsulfanyl-4-(2-pyri…
| 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) | 2.97 | 0.93 | -15.99 | 0 | 7 | 0 | 80 | 421.526 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.97 | 1.07 | -36.59 | 1 | 7 | 1 | 82 | 422.534 | 7 | ↓ |
