| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 19 | Yes |
Popular Name: (2S,6R)-1-[(3-chlorobenzothiophen-2-yl)methyl]-2,6-dimethyl-piperazine (2S,6R)-1-[(3-chlorobenzothiophe…
| 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) | 3.51 | 6.06 | -37.68 | 2 | 2 | 1 | 20 | 295.859 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.51 | 4.7 | -4.26 | 1 | 2 | 0 | 15 | 294.851 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
