| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 19 | Yes |
Popular Name: 1-[4-(4-aminobutyl)-1,4-diazepan-1-yl]-4-methyl-pentan-1-one 1-[4-(4-aminobutyl)-1,4-diazepan…
| 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) | 1.10 | 7.19 | -104.86 | 4 | 4 | 2 | 52 | 271.449 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.10 | 5.39 | -48.53 | 3 | 4 | 1 | 51 | 270.441 | 7 | ↓ |
