In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 31 | Yes |
Popular Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-methoxy-3-(p-tolylsulfamoyl)benzamide N-(5-isobutyl-1,3,4-thiadiazol-2…
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) | 3.78 | 7.45 | -29.89 | 2 | 8 | 0 | 110 | 460.581 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 7.52 | -67.52 | 1 | 8 | -1 | 112 | 459.573 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 6.54 | -57.23 | 1 | 8 | -1 | 117 | 459.573 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 6.61 | -112.8 | 0 | 8 | -2 | 119 | 458.565 | 8 | ↓ |