| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 21 | Yes |
Popular Name: 2-[4-[(6-chloro-3-pyridyl)methyl]piperazin-1-yl]-N-isopropyl-acetamide 2-[4-[(6-chloro-3-pyridyl)methyl…
| 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) | 1.70 | 4.59 | -46 | 2 | 5 | 1 | 50 | 311.837 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.70 | 2.32 | -9.85 | 1 | 5 | 0 | 48 | 310.829 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
