| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 25 | Yes |
Popular Name: [4-[(4-chlorophenyl)methyl]piperazin-1-yl]-(2-ethylsulfanyl-3-pyridyl)methanone [4-[(4-chlorophenyl)methyl]piper…
| 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) | 2.90 | 8.41 | -11.9 | 0 | 4 | 0 | 36 | 375.925 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.90 | 10.62 | -53.08 | 1 | 4 | 1 | 38 | 376.933 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
