| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 25 | Yes |
Popular Name: 4-[[4-[[2-(hydroxymethyl)phenyl]methyl]piperazin-1-yl]methyl]benzoic 4-[[4-[[2-(hydroxymethyl)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) | 2.23 | 7.46 | -76.43 | 2 | 5 | 0 | 68 | 340.423 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 7.53 | -76.11 | 2 | 5 | 0 | 68 | 340.423 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.23 | 5.26 | -51.1 | 1 | 5 | -1 | 67 | 339.415 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
