| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 30 | Yes |
Popular Name: benzyl-[[[(2R)-2-hydroxypropyl]-isopropyl-amino]methyl]BLAHone benzyl-[[[(2R)-2-hydroxypropyl]-…
| 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) | 2.47 | 7.56 | -49.13 | 3 | 6 | 1 | 74 | 427.594 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.92 | 4.84 | -45.57 | 2 | 6 | 0 | 77 | 426.586 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 5.57 | -12.74 | 2 | 6 | 0 | 72 | 426.586 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.47 | 9.85 | -93.28 | 4 | 6 | 2 | 75 | 428.602 | 7 | ↓ |
