| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: (2S)-2-amino-1-[(2R)-2-(1-methylpyrrol-2-yl)azepan-1-yl]propan-1-one (2S)-2-amino-1-[(2R)-2-(1-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) | 1.09 | 5.38 | -42.8 | 3 | 4 | 1 | 53 | 250.366 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.09 | 5.05 | -7.85 | 2 | 4 | 0 | 51 | 249.358 | 2 | ↓ |
