| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 21 | Yes |
Popular Name: 2-[[(1S)-1-methylpropyl]amino]-1-[(2S)-2-(1-methylpyrrol-2-yl)azepan-1-yl]ethanone 2-[[(1S)-1-methylpropyl]amino]-1…
| 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) | 2.87 | 9.2 | -39.25 | 2 | 4 | 1 | 42 | 292.447 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.87 | 7.99 | -8.03 | 1 | 4 | 0 | 37 | 291.439 | 5 | ↓ |
