| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 13th, 2007 | 16 | Yes |
Popular Name: 2-[(8-ethyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)sulfanyl]propanenitrile 2-[(8-ethyl-7-thia-3,5-diazabicy…
| 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) | 2.96 | 8.23 | -7.19 | 0 | 3 | 0 | 50 | 249.364 | 3 | ↓ |
