| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 21 | Yes |
Popular Name: 7-(2-ethoxyphenyl)-3-isobutyl-4-thia-1,2,6-triazabicyclo[3.3.0]octa-2,5,7-triene 7-(2-ethoxyphenyl)-3-isobutyl-4-…
| 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) | 3.79 | 9.66 | -12.77 | 0 | 4 | 0 | 39 | 301.415 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 10.16 | -22.42 | 1 | 4 | 1 | 41 | 302.423 | 5 | ↓ |
