| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2008 | 19 | Yes |
Popular Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-methyl-1,4-diazepane 1-[(3,4-dimethoxyphenyl)methyl]-…
| 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) | 1.55 | 5.85 | -40.08 | 1 | 4 | 1 | 26 | 265.377 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.55 | 4.02 | -6.38 | 0 | 4 | 0 | 25 | 264.369 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 8.03 | -115.65 | 2 | 4 | 2 | 27 | 266.385 | 4 | ↓ |
