| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 18 | Yes |
Popular Name: 2-(methylamino)-1-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone 2-(methylamino)-1-[(2S)-2-(1-met…
| 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) | 1.67 | 7.03 | -41.79 | 2 | 4 | 1 | 42 | 250.366 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.67 | 5.58 | -8.49 | 1 | 4 | 0 | 37 | 249.358 | 3 | ↓ |
