| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 31 | Yes |
Popular Name: benzyl-[[(2-hydroxy-2-methyl-propyl)-propyl-amino]methyl]BLAHone benzyl-[[(2-hydroxy-2-methyl-pro…
None
None
| 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) | 3.12 | 9.21 | -48.96 | 3 | 6 | 1 | 74 | 441.621 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.12 | 6.37 | -12.71 | 2 | 6 | 0 | 72 | 440.613 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | 10.35 | -91.66 | 4 | 6 | 2 | 75 | 442.629 | 8 | ↓ |
