| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 17th, 2004 | 36 | No |
Popular Name: (5S)-1-homoveratryl-2-keto-5-(3-methoxyphenyl)-4-p-toluoyl-3-pyrrolin-3-olate (5S)-1-homoveratryl-2-keto-5-(3-…
| 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) | 4.31 | 11.42 | -61.84 | 0 | 7 | -1 | 88 | 486.544 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.76 | 10.4 | -29.1 | 1 | 7 | 0 | 85 | 487.552 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.73 | 11.39 | -22.31 | 0 | 7 | 0 | 82 | 487.552 | 9 | ↓ |
