| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2010 | 20 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-(2-methylbenzimidazol-1-yl)ethanone 1-(1,4-diazepan-1-yl)-2-(2-methy…
| 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) | 0.50 | 7.16 | -58.2 | 2 | 5 | 1 | 55 | 273.36 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.50 | 5.82 | -16.8 | 1 | 5 | 0 | 50 | 272.352 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.50 | 7.6 | -90.49 | 3 | 5 | 2 | 56 | 274.368 | 2 | ↓ |
