| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2011 | 21 | Yes |
Popular Name: [3-chloro-4-[4-(2-pyridyl)piperazin-1-yl]phenyl]methanamine [3-chloro-4-[4-(2-pyridyl)pipera…
| 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) | 2.52 | 7.88 | -81.51 | 4 | 4 | 2 | 48 | 304.825 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.52 | 7.56 | -50.79 | 3 | 4 | 1 | 47 | 303.817 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
