In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 30 | No |
Popular Name: (2E)-7-[(dibutylamino)methyl]-6-hydroxy-4-methyl-2-(p-tolylmethylene)benzofuran-3-one (2E)-7-[(dibutylamino)methyl]-6-…
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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) | 6.63 | 13.37 | -41.45 | 2 | 4 | 1 | 55 | 408.562 | 9 | ↓ |
Mid Mid (pH 6-8) | 6.63 | 14 | -28.03 | 1 | 4 | 0 | 58 | 407.554 | 9 | ↓ |