| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 21st, 2009 | 22 | Yes |
Popular Name: 4-Chloro-2-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)phenol 4-Chloro-2-({[2-(3,4-dimethoxyph…
| 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) | 3.54 | 4.52 | -10.92 | 2 | 4 | 0 | 51 | 321.804 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 6.79 | -38.15 | 2 | 4 | 0 | 58 | 321.804 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.54 | 5.31 | -43.45 | 1 | 4 | -1 | 54 | 320.796 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 6.01 | -51.76 | 3 | 4 | 1 | 55 | 322.812 | 7 | ↓ |
