In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2008 | 32 | Yes |
Popular Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-[5-(p-tolyl)-1,3,4-thiadiazol-2-yl]acetamide 2-(4-benzylsulfonylpiperazin-1-y…
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) | 3.46 | 6.81 | -27.63 | 1 | 8 | 0 | 96 | 471.608 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.28 | 5.86 | -52.18 | 0 | 8 | -1 | 102 | 470.6 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.46 | 9.14 | -71.98 | 2 | 8 | 1 | 97 | 472.616 | 7 | ↓ |