| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 34 | No |
Popular Name: 3,5-difluoro-N-[6-[4-[(4-nitrophenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 3,5-difluoro-N-[6-[4-[(4-nitroph…
| 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) | 3.98 | 13.75 | -59.5 | 2 | 8 | 1 | 95 | 468.484 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.98 | 11.94 | -13.64 | 1 | 8 | 0 | 94 | 467.476 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.98 | 14.1 | -122.38 | 3 | 8 | 2 | 97 | 469.492 | 6 | ↓ |
