| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 20 | Yes |
Popular Name: 1-(2,5-dibromo-3-thienyl)-2-[2-dimethylaminoethyl(isobutyl)amino]ethanone 1-(2,5-dibromo-3-thienyl)-2-[2-d…
| 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) | 4.10 | 9.11 | -39.81 | 1 | 3 | 1 | 25 | 427.226 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.10 | 6.79 | -4.99 | 0 | 3 | 0 | 24 | 426.218 | 8 | ↓ |
| Hi High (pH 8-9.5) | 4.10 | 8.43 | -37.34 | 1 | 3 | 1 | 25 | 427.226 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 4.10 | 10.76 | -117.45 | 2 | 3 | 2 | 26 | 428.234 | 8 | ↓ |
