In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 36 | No |
Popular Name: 4-benzoyl-3-hydroxy-1-(6-methoxybenzothiazol-2-yl)-5-(4-propoxyphenyl)-5H-pyrrol-2-one 4-benzoyl-3-hydroxy-1-(6-methoxy…
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) | 5.60 | 12.68 | -54.49 | 0 | 7 | -1 | 92 | 499.568 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.02 | 11.85 | -17.05 | 0 | 7 | 0 | 86 | 500.576 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.05 | 10.82 | -27.56 | 1 | 7 | 0 | 89 | 500.576 | 7 | ↓ |