| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 6th, 2010 | 20 | Yes |
Popular Name: 2-[[(1S,2R)-2-amino-1-(4-chlorophenyl)butyl]-butyl-amino]ethanol 2-[[(1S,2R)-2-amino-1-(4-chlorop…
| 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) | 3.15 | 5.32 | -115.12 | 5 | 3 | 2 | 52 | 300.874 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 5.07 | -33.18 | 4 | 3 | 1 | 51 | 299.866 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 3.12 | -45.23 | 4 | 3 | 1 | 51 | 299.866 | 9 | ↓ |
