| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 18 | Yes |
Popular Name: 2-[[(1S,2R)-2-amino-1-phenyl-propyl]-butyl-amino]ethanol 2-[[(1S,2R)-2-amino-1-phenyl-pro…
| 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) | 1.94 | 3.99 | -105.44 | 5 | 3 | 2 | 52 | 252.402 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 3.69 | -29.23 | 4 | 3 | 1 | 51 | 251.394 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 2.48 | -38.41 | 4 | 3 | 1 | 51 | 251.394 | 8 | ↓ |
