| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1,4-diazepan-1-yl]ethanamine 2-[4-[(3,4-dimethoxyphenyl)methy…
| 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) | 0.35 | 3.73 | -100.43 | 4 | 5 | 2 | 54 | 295.427 | 6 | ↓ |
| Hi High (pH 8-9.5) | 0.35 | 3.34 | -39.63 | 3 | 5 | 1 | 52 | 294.419 | 6 | ↓ |
