In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2011 | 22 | Yes |
Popular Name: 1-(4-methyl-1-piperidyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanone 1-(4-methyl-1-piperidyl)-2-[(4-p…
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) | 2.15 | 11.08 | -11.6 | 0 | 5 | 0 | 51 | 316.43 | 4 | ↓ |