| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 15 | Yes |
Popular Name: (2S,6R)-1-[(3-bromo-2-thienyl)methyl]-2,6-dimethyl-piperazine (2S,6R)-1-[(3-bromo-2-thienyl)me…
| 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) | 2.33 | 3.7 | -36.76 | 2 | 2 | 1 | 20 | 290.25 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.33 | 2.35 | -2.53 | 1 | 2 | 0 | 15 | 289.242 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
