| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 30th, 2011 | 18 | Yes |
Popular Name: (2S)-1-(4-bromo-2-fluoro-phenyl)-3-(4-pyridyl)propan-2-amine (2S)-1-(4-bromo-2-fluoro-phenyl)…
| 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) | 2.40 | 6.89 | -45.47 | 3 | 2 | 1 | 41 | 310.19 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.40 | 6.67 | -6.18 | 2 | 2 | 0 | 39 | 309.182 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.40 | 7.35 | -102.49 | 4 | 2 | 2 | 42 | 311.198 | 4 | ↓ |
