| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 26th, 2004 | 18 | No |
Popular Name: (5R)-4-acetyl-1-(cyanomethyl)-2-keto-5-(2-thienyl)-3-pyrrolin-3-olate (5R)-4-acetyl-1-(cyanomethyl)-2-…
| 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) | 0.46 | 4.81 | -58.69 | 0 | 5 | -1 | 84 | 261.282 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.46 | 3.87 | -20.06 | 1 | 5 | 0 | 81 | 262.29 | 3 | ↓ |
