| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2008 | 24 | Yes |
Popular Name: azepan-1-yl-[2-(4-ethylpiperazin-1-yl)-4-methyl-pyrimidin-5-yl]methanone azepan-1-yl-[2-(4-ethylpiperazin…
| 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) | 1.82 | 9.45 | -42.3 | 1 | 6 | 1 | 54 | 332.472 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.82 | 7.08 | -7.45 | 0 | 6 | 0 | 53 | 331.464 | 3 | ↓ |
