| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 4th, 2005 | 14 | Yes |
Popular Name: 2-[(8-methyl-7-thia-3,5-diazabicyclo[4.3.0]nona-1,3,5,8-tetraen-2-yl)sulfanyl]acetonitrile 2-[(8-methyl-7-thia-3,5-diazabic…
| 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) | 2.03 | 0.2 | -8.72 | 0 | 3 | 0 | 50 | 221.31 | 2 | ↓ |
