| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 17 | Yes |
Popular Name: (1S)-1-[4-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanamine (1S)-1-[4-(4-methyl-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) | 0.07 | 5.41 | -88.72 | 4 | 3 | 2 | 35 | 235.375 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | 3.36 | -44.86 | 3 | 3 | 1 | 34 | 234.367 | 2 | ↓ |
