| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 20 | Yes |
Popular Name: 4-[[[(1R)-1-(2,5-dimethylphenyl)ethyl]amino]methyl]benzene-1,3-diol 4-[[[(1R)-1-(2,5-dimethylphenyl)…
| 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) | 3.72 | 4.49 | -42.05 | 4 | 3 | 1 | 57 | 272.368 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.72 | 3.44 | -6.87 | 3 | 3 | 0 | 52 | 271.36 | 4 | ↓ |
