| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 15 | Yes |
Popular Name: (2S)-3-[(3-chloro-4-fluoro-phenyl)methylamino]propane-1,2-diol (2S)-3-[(3-chloro-4-fluoro-pheny…
| 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) | 0.99 | 0.27 | -52.54 | 4 | 3 | 1 | 57 | 234.678 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | -1.08 | -8.51 | 3 | 3 | 0 | 52 | 233.67 | 5 | ↓ |
