| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 1st, 2011 | 22 | Yes |
Popular Name: (2S)-1-(azepan-1-yl)-2-(4-hydroxy-6-propyl-pyrimidin-2-yl)sulfanyl-propan-1-one (2S)-1-(azepan-1-yl)-2-(4-hydrox…
| 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) | 3.58 | 8.01 | -11.37 | 1 | 5 | 0 | 66 | 323.462 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 6.34 | -46.67 | 0 | 5 | -1 | 69 | 322.454 | 5 | ↓ |
