| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: (3R)-3-amino-4-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]-4-oxo-butanamide (3R)-3-amino-4-[(2S)-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) | 0.97 | 2.48 | -38.84 | 5 | 6 | 1 | 96 | 293.391 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 2.13 | -11.23 | 4 | 6 | 0 | 94 | 292.383 | 4 | ↓ |
