In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 26th, 2006 | 20 | Yes |
Popular Name: 4-butyl-5-[2-(5-chloro-2-thienyl)-2-oxo-ethyl]sulfanyl-2H-1,2,4-triazol-3-one 4-butyl-5-[2-(5-chloro-2-thienyl…
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) | 3.31 | -2.44 | -8.6 | 1 | 5 | 0 | 67 | 331.85 | 7 | ↓ |