| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 22nd, 2010 | 20 | No |
Popular Name: 1-(5-bromo-2-thienyl)-2-[1-(3-methylbut-2-enyl)-4-piperidylidene]ethanone 1-(5-bromo-2-thienyl)-2-[1-(3-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) | 4.86 | 11.24 | -37.44 | 1 | 2 | 1 | 22 | 355.321 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.86 | 9.03 | -3.74 | 0 | 2 | 0 | 20 | 354.313 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
