| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 19th, 2010 | 28 | Yes |
Popular Name: 1-[2-[[4-ethyl-5-(3,4,5-trimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethyl]piperidine 1-[2-[[4-ethyl-5-(3,4,5-trimetho…
| 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) | 3.44 | 11.24 | -46.53 | 1 | 7 | 1 | 63 | 407.56 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.44 | 9.03 | -12.58 | 0 | 7 | 0 | 62 | 406.552 | 9 | ↓ |
