| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 36 | Yes |
Popular Name: 4-fluoro-N-[6-[4-[(2,3,4-trimethoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 4-fluoro-N-[6-[4-[(2,3,4-trimeth…
| 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) | 3.75 | 12.22 | -46.71 | 2 | 8 | 1 | 77 | 495.575 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 10.37 | -14.54 | 1 | 8 | 0 | 76 | 494.567 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.75 | 12.58 | -106.97 | 3 | 8 | 2 | 79 | 496.583 | 8 | ↓ |
