| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 24 | Yes |
Popular Name: 2-[4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]pyridine-4-carboxamide 2-[4-[(2-chloro-4-fluoro-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) | 1.97 | 4.98 | -10.98 | 2 | 5 | 0 | 62 | 348.809 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.97 | 7.1 | -44.41 | 3 | 5 | 1 | 64 | 349.817 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
