In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 24 | Yes |
Popular Name: N-(5-butyl-1,3,4-thiadiazol-2-yl)-5-methoxy-2,3-dihydro-1,4-benzodioxine-7-carboxamide N-(5-butyl-1,3,4-thiadiazol-2-yl…
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) | 2.39 | 6.27 | -20.49 | 1 | 7 | 0 | 83 | 349.412 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 5.34 | -48.52 | 0 | 7 | -1 | 89 | 348.404 | 6 | ↓ |