| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 16 | Yes |
Popular Name: (2S)-3-[(3-chloro-4-fluoro-phenyl)methylamino]-2-methyl-propanoic (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) | 2.26 | 7.17 | -55.8 | 2 | 3 | 0 | 57 | 245.681 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.26 | 6 | -43.33 | 1 | 3 | -1 | 52 | 244.673 | 5 | ↓ |
