| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 22 | No |
Popular Name: 4-[[3-(benzyl-methyl-amino)propylamino]methyl]benzene-1,2-diol 4-[[3-(benzyl-methyl-amino)propy…
| 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) | 2.23 | 3.65 | -49.86 | 4 | 4 | 1 | 60 | 301.41 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 6.97 | -136.44 | 4 | 4 | 1 | 64 | 301.41 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.23 | 7.12 | -113.44 | 4 | 4 | 1 | 64 | 301.41 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 4.61 | -42.97 | 4 | 4 | 1 | 57 | 301.41 | 8 | ↓ |
