In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2010 | 19 | No |
Popular Name: (2Z)-6-hydroxy-7-methyl-2-(4-pyridylmethylene)benzofuran-3-one (2Z)-6-hydroxy-7-methyl-2-(4-pyr…
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) | 2.29 | 4.59 | -9.23 | 1 | 4 | 0 | 63 | 253.257 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.29 | 5.37 | -39.71 | 0 | 4 | -1 | 66 | 252.249 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.29 | 5.07 | -40.6 | 2 | 4 | 1 | 65 | 254.265 | 1 | ↓ |