| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 25th, 2006 | 17 | Yes |
Popular Name: 7-(4-ethoxyphenyl)-4-thia-1,2,6-triazabicyclo[3.3.0]octa-2,5,7-triene 7-(4-ethoxyphenyl)-4-thia-1,2,6-…
| 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) | 2.80 | 0.67 | -13.32 | 0 | 4 | 0 | 39 | 245.307 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.80 | 0.91 | -31.6 | 1 | 4 | 1 | 41 | 246.315 | 3 | ↓ |
