| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 22 | Yes |
Popular Name: 2-(azepan-1-yl)-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]acetamide 2-(azepan-1-yl)-N-[2-[(4-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) | 1.55 | 5.48 | -49.68 | 4 | 7 | 1 | 91 | 308.406 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 3.6 | -15.36 | 3 | 7 | 0 | 90 | 307.398 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![2-(azepan-1-yl)-N-[2-[(6-keto-1H-pyrimidin-2-yl)amino]ethyl]acetamide](http://zinc12.docking.org/img/rings/399023.gif)