| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 24 | No |
Popular Name: 2-{[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]thio}benzoic acid 2-{[1-(4-methylphenyl)-2,5-dioxo…
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CAS Number: N/A
| 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) | 2.37 | 10.19 | -54.46 | 0 | 5 | -1 | 78 | 340.38 | 4 | ↓ |
| Ref Reference (pH 7) | 3.87 | 6.08 | -55.05 | 2 | 5 | -1 | 86 | 340.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 6.84 | -121.96 | 1 | 5 | -2 | 88 | 339.372 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.87 | 6.84 | -114.25 | 1 | 5 | -2 | 88 | 339.372 | 4 | ↓ |
