In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 29 | No |
Popular Name: (2Z)-7-(azepan-1-ylmethyl)-2-[(4-ethylphenyl)methylene]-6-hydroxy-4-methyl-benzofuran-3-one (2Z)-7-(azepan-1-ylmethyl)-2-[(4…
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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) | 5.63 | 12.11 | -41.02 | 2 | 4 | 1 | 55 | 392.519 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.63 | 13.01 | -26.66 | 1 | 4 | 0 | 58 | 391.511 | 4 | ↓ |