In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: 3-[(4-hydroxy-4-oxo-butyl)sulfonylamino]-2-methyl-benzoic 3-[(4-hydroxy-4-oxo-butyl)sulfon…
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) | 0.88 | 4.89 | -98.83 | 1 | 7 | -2 | 126 | 299.304 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.88 | 4.97 | -169.06 | 0 | 7 | -3 | 128 | 298.296 | 7 | ↓ |