| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 18th, 2006 | 17 | Yes |
Popular Name: 4-Butyl-5-hydroxy-7-methyl-2H-chromen-2-one 4-Butyl-5-hydroxy-7-methyl-2H-ch…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 690680-03-6
| 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) | 3.94 | 7.29 | -9.83 | 1 | 3 | 0 | 50 | 232.279 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.94 | 7.73 | -33.77 | 0 | 3 | -1 | 53 | 231.271 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
