| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 19 | Yes |
Popular Name: 4-methyl-3-[3-(4-methyl-1,4-diazepan-1-yl)-3-oxo-propyl]thiazol-2-one 4-methyl-3-[3-(4-methyl-1,4-diaz…
| 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) | 0.39 | 6.99 | -44.02 | 1 | 5 | 1 | 47 | 284.405 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | 4.92 | -11.92 | 0 | 5 | 0 | 46 | 283.397 | 3 | ↓ |
![3-[3-(1,4-diazepan-1-yl)-3-keto-propyl]-4-thiazolin-2-one](http://zinc12.docking.org/img/rings/219079.gif)
