| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 24 | Yes |
Popular Name: 3-methyl-N-[6-(4-propanoyl-1,4-diazepan-1-yl)-3-pyridyl]but-2-enamide 3-methyl-N-[6-(4-propanoyl-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) | 2.53 | 8.23 | -12.73 | 1 | 6 | 0 | 66 | 330.432 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 8.58 | -40.65 | 2 | 6 | 1 | 67 | 331.44 | 4 | ↓ |
