| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 29 | Yes |
Popular Name: [[(2S)-2-hydroxy-3-phenyl-propyl]-isobutyl-amino]methylBLAHone [[(2S)-2-hydroxy-3-phenyl-propyl…
| 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) | 3.59 | 10.87 | -58.99 | 3 | 5 | 1 | 70 | 412.579 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.05 | 7.86 | -53.07 | 2 | 5 | 0 | 74 | 411.571 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 8.83 | -13.95 | 2 | 5 | 0 | 69 | 411.571 | 8 | ↓ |
