| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2009 | 28 | Yes |
Popular Name: 3-fluoro-N-[6-[4-(2-thienylmethyl)piperazin-1-yl]-3-pyridyl]benzamide 3-fluoro-N-[6-[4-(2-thienylmethy…
| 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) | 3.53 | 8.83 | -9.47 | 1 | 5 | 0 | 48 | 396.491 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 9.15 | -36.01 | 2 | 5 | 1 | 50 | 397.499 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 11.06 | -43.22 | 2 | 5 | 1 | 50 | 397.499 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 11.37 | -103.03 | 3 | 5 | 2 | 51 | 398.507 | 5 | ↓ |
