| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 32 | Yes |
Popular Name: benzyl-[[[(2R)-2-hydroxypentyl]-propyl-amino]methyl]BLAHone benzyl-[[[(2R)-2-hydroxypentyl]-…
| 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) | 3.73 | 9.68 | -52.55 | 3 | 6 | 1 | 74 | 455.648 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.73 | 7.39 | -12.61 | 2 | 6 | 0 | 72 | 454.64 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.19 | 6.95 | -45.77 | 2 | 6 | 0 | 77 | 454.64 | 10 | ↓ |
