| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2012 | 28 | Yes |
Popular Name: 4-(4-ethyl-1,4-diazepane-1-carbonyl)-N-(p-tolyl)benzenesulfonamide 4-(4-ethyl-1,4-diazepane-1-carbo…
| 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) | 2.66 | 8.75 | -44.92 | 2 | 6 | 1 | 71 | 402.54 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.66 | 6.94 | -46.62 | 0 | 6 | -1 | 72 | 400.524 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.66 | 8.78 | -69.46 | 1 | 6 | 0 | 73 | 401.532 | 5 | ↓ |
