| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 20 | Yes |
Popular Name: (6E)-3-methyl-6-[5-(p-tolyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one (6E)-3-methyl-6-[5-(p-tolyl)-1,2…
| 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) | 4.27 | 6.82 | -8.51 | 2 | 3 | 0 | 49 | 264.328 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 7.58 | -55.06 | 1 | 3 | -1 | 52 | 263.32 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.27 | 7.51 | -45.8 | 1 | 3 | -1 | 52 | 263.32 | 2 | ↓ |
