| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 20 | Yes |
Popular Name: 3-[4-(pyridine-2-carbonyl)-1,4-diazepan-1-yl]propanamide 3-[4-(pyridine-2-carbonyl)-1,4-d…
| 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) | -0.63 | 4.47 | -48.31 | 3 | 6 | 1 | 81 | 277.348 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.63 | 2.67 | -14.61 | 2 | 6 | 0 | 80 | 276.34 | 4 | ↓ |
