| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2005 | 26 | No |
Popular Name: C[C@H]1CCc2c(sc(c2C(=O)N)NC(=O)/C(=C/c3ccccc3)/C#N)C1 C[C@H]1CCc2c(sc(c2C(=O)N)NC(=O)/…
| 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) | 3.37 | 6.67 | -13.73 | 3 | 5 | 0 | 96 | 365.458 | 4 | ↓ |
