| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 18 | Yes |
Popular Name: 1-(1,4-diazepan-1-yl)-2-[methyl(2-thienylmethyl)amino]ethanone 1-(1,4-diazepan-1-yl)-2-[methyl(…
| 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) | 0.56 | 6.83 | -99.24 | 3 | 4 | 2 | 41 | 269.414 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.56 | 4.58 | -46.87 | 2 | 4 | 1 | 40 | 268.406 | 4 | ↓ |
