| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 24 | No |
Popular Name: 7-(2-cyano-3-phenyl-prop-2-enoyl)amino-6-thiabicyclo[3.3.0]octa-7,9-diene-8-carboxamide 7-(2-cyano-3-phenyl-prop-2-enoyl…
| 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) | 2.38 | 5.57 | -13.38 | 3 | 5 | 0 | 96 | 337.404 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 4.03 | -46.43 | 2 | 5 | -1 | 102 | 336.396 | 4 | ↓ |
