In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2006 | 30 | Yes |
Popular Name: 2-[(5-benzyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)-ethanone 2-[(5-benzyl-4-ethyl-1,2,4-triaz…
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) | 3.76 | -1.02 | -13.24 | 0 | 6 | 0 | 54 | 421.57 | 7 | ↓ |