| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 17 | Yes |
Popular Name: 1-[4-[(4-methyl-1,2,4-triazol-3-yl)methylamino]-1-piperidyl]ethanone 1-[4-[(4-methyl-1,2,4-triazol-3-…
| 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) | -1.10 | 5.52 | -59.8 | 2 | 6 | 1 | 68 | 238.315 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.10 | 4.32 | -16.55 | 1 | 6 | 0 | 63 | 237.307 | 3 | ↓ |
