| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: 2-[4-[(2S)-2-amino-2-phenyl-acetyl]-1,4-diazepan-1-yl]acetamide 2-[4-[(2S)-2-amino-2-phenyl-acet…
| 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) | -2.33 | 2.09 | -40.05 | 5 | 6 | 1 | 94 | 291.375 | 4 | ↓ |
| Hi High (pH 8-9.5) | -2.33 | 0.39 | -11.32 | 4 | 6 | 0 | 93 | 290.367 | 4 | ↓ |
| Mid Mid (pH 6-8) | -2.33 | 2.41 | -97.13 | 6 | 6 | 2 | 95 | 292.383 | 4 | ↓ |
