| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2004 | 31 | No |
Popular Name: (5R)-5-(3,4-dimethoxyphenyl)-2-keto-4-p-toluoyl-1-(1,3,4-thiadiazol-2-yl)-3-pyrrolin-3-olate (5R)-5-(3,4-dimethoxyphenyl)-2-k…
| 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) | 2.89 | 9.02 | -54.33 | 0 | 8 | -1 | 105 | 436.469 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.33 | 0.61 | -27.77 | 1 | 8 | 0 | 101 | 437.477 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 0.9 | -20.34 | 0 | 8 | 0 | 98 | 437.477 | 6 | ↓ |
