| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2010 | 23 | Yes |
Popular Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(2-pyridyl)piperazine 1-[3-chloro-5-(trifluoromethyl)-…
| 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) | 3.34 | 9.7 | -30.52 | 1 | 4 | 1 | 34 | 343.76 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 9.38 | -5.37 | 0 | 4 | 0 | 32 | 342.752 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
