| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 16th, 2010 | 18 | Yes |
Popular Name: 3-hydroxy-N-[(1-methyl-4-piperidyl)methyl]pyridine-2-carboxamide 3-hydroxy-N-[(1-methyl-4-piperid…
| 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) | 0.88 | 2.31 | -50.64 | 1 | 5 | -1 | 68 | 248.306 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 3.7 | -42.2 | 3 | 5 | 1 | 67 | 250.322 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 5.16 | -77.45 | 3 | 5 | 1 | 71 | 250.322 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.88 | 4.7 | -71.41 | 2 | 5 | 0 | 69 | 249.314 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.88 | 4.16 | -91.2 | 4 | 5 | 2 | 68 | 251.33 | 3 | ↓ |
