In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 8th, 2004 | 30 | Yes |
Popular Name: 1-[(2S,6S)-2,6-dimethylpiperidino]-2-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]ethanone 1-[(2S,6S)-2,6-dimethylpiperidin…
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) | 5.13 | 1.88 | -11.51 | 0 | 5 | 0 | 51 | 420.582 | 5 | ↓ |