| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 27th, 2006 | 22 | Yes |
Popular Name: 7-butyl-3-(4-ethoxyphenyl)-2-methyl-6-thia-1,4,8-triazabicyclo[3.3.0]octa-2,4,7-triene 7-butyl-3-(4-ethoxyphenyl)-2-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) | 4.37 | 9.96 | -11.53 | 0 | 4 | 0 | 39 | 315.442 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.37 | 10.36 | -25.92 | 1 | 4 | 1 | 41 | 316.45 | 6 | ↓ |
