| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 1st, 2010 | 25 | Yes |
Popular Name: (2S)-2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-1-yl]-N,N-diethyl-propanamide (2S)-2-[4-[2-(azepan-1-yl)-2-oxo…
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| 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) | 1.43 | 8.12 | -37.36 | 1 | 6 | 1 | 48 | 353.531 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 7.97 | -37.33 | 1 | 6 | 1 | 48 | 353.531 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 5.77 | -11.13 | 0 | 6 | 0 | 47 | 352.523 | 6 | ↓ |
