In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2008 | 30 | Yes |
Popular Name: N-(6-phenoxy-3-pyridyl)-1-[2-(1,2,4-triazol-1-yl)acetyl]piperidine-4-carboxamide N-(6-phenoxy-3-pyridyl)-1-[2-(1,…
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) | 1.41 | 8.57 | -29.51 | 1 | 9 | 0 | 102 | 406.446 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.41 | 9.23 | -54.41 | 2 | 9 | 1 | 103 | 407.454 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.