| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 29th, 2008 | 21 | Yes |
Popular Name: (6E)-4-chloro-6-[5-(2-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one (6E)-4-chloro-6-[5-(2-methoxyphe…
| 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) | 4.06 | 5.49 | -8.19 | 2 | 4 | 0 | 58 | 300.745 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.08 | 6.73 | -56.61 | 0 | 4 | -1 | 57 | 299.737 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.06 | 6.26 | -43.26 | 1 | 4 | -1 | 61 | 299.737 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 6.25 | -50.44 | 1 | 4 | -1 | 61 | 299.737 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
