| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 32 | No |
Popular Name: 3-fluoro-N-[6-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]-3-pyridyl]benzamide 3-fluoro-N-[6-[4-[(2-nitrophenyl…
| 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) | 3.54 | 10.86 | -18.08 | 1 | 8 | 0 | 94 | 435.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 12.6 | -48.97 | 2 | 8 | 1 | 95 | 436.467 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.54 | 12.93 | -109.67 | 3 | 8 | 2 | 97 | 437.475 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.54 | 11.18 | -44.51 | 2 | 8 | 1 | 96 | 436.467 | 6 | ↓ |
