| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 20 | Yes |
Popular Name: 1-(2,2-dimethylpropyl)-4-[(5-methyl-2-thienyl)sulfonyl]piperazine 1-(2,2-dimethylpropyl)-4-[(5-met…
| 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) | 3.01 | 5.11 | -8.04 | 0 | 4 | 0 | 41 | 316.492 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.01 | 6.64 | -42.89 | 1 | 4 | 1 | 42 | 317.5 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
