In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 25 | Yes |
Popular Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-butoxy-3,5-dichloro-benzamide N-(5-allylsulfanyl-1,3,4-thiadia…
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) | 5.62 | 9.79 | -11.83 | 1 | 5 | 0 | 64 | 418.371 | 9 | ↓ |
Hi High (pH 8-9.5) | 5.69 | 8.1 | -40.78 | 0 | 5 | -1 | 70 | 417.363 | 9 | ↓ |