In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 28 | Yes |
Popular Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-(phenylsulfamoyl)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) | 3.34 | 6.9 | -23.31 | 2 | 7 | 0 | 101 | 416.528 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 6.08 | -93.86 | 0 | 7 | -2 | 109 | 414.512 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 6.01 | -49.5 | 1 | 7 | -1 | 107 | 415.52 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.97 | -49.7 | 1 | 7 | -1 | 103 | 415.52 | 7 | ↓ |