| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: N-(2-cyanoethyl)-3-hydroxy-N-isobutyl-pyridine-2-carboxamide N-(2-cyanoethyl)-3-hydroxy-N-iso…
| 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) | 0.90 | 6.33 | -10.9 | 1 | 5 | 0 | 77 | 247.298 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 6.82 | -38.87 | 1 | 5 | 0 | 81 | 247.298 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 7.34 | -50.14 | 0 | 5 | -1 | 80 | 246.29 | 5 | ↓ |
