| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 27th, 2006 | 22 | Yes |
Popular Name: 2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-pyrrolidin-1-yl-ethanone 2-[[5-(4-methoxyphenyl)-1H-1,2,4…
| 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) | 2.24 | 6.6 | -10.97 | 1 | 6 | 0 | 71 | 318.402 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 6.4 | -47.16 | 0 | 6 | -1 | 69 | 317.394 | 5 | ↓ |
