| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2007 | 30 | No |
Popular Name: 4-benzoyl-3-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(4-nitrophenyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-1-(5-methyl-…
| 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) | 2.47 | 9.72 | -51.34 | 0 | 9 | -1 | 132 | 421.414 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.91 | 8.66 | -28.43 | 1 | 9 | 0 | 129 | 422.422 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 9.63 | -21.51 | 0 | 9 | 0 | 126 | 422.422 | 5 | ↓ |
