| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 17 | Yes |
Popular Name: 2-(4-methyl-1,4-diazepan-1-yl)-1-(1-methylpyrrol-3-yl)ethanone 2-(4-methyl-1,4-diazepan-1-yl)-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) | 0.56 | 6.74 | -34.4 | 1 | 4 | 1 | 30 | 236.339 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 4.35 | -9.15 | 0 | 4 | 0 | 28 | 235.331 | 3 | ↓ |
