| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2010 | 20 | Yes |
Popular Name: (2S)-2-(4-fluoro-3-methyl-phenyl)-2-(4-methyl-1,4-diazepan-1-yl)acetic (2S)-2-(4-fluoro-3-methyl-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) | 1.87 | 8.49 | -57.26 | 1 | 4 | 0 | 48 | 280.343 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.87 | 8.23 | -26.19 | 1 | 4 | 0 | 48 | 280.343 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.87 | 10.19 | -81.93 | 2 | 4 | 1 | 49 | 281.351 | 3 | ↓ |
