| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 34 | Yes |
Popular Name: Cromolyn Cromolyn
Find On: PubMed — Wikipedia — Google
CAS Numbers: 15826-37-6 , 16110-51-3
5-[3-(2-carboxy-4-oxochromen-6-yl)oxy-2-hydroxypropoxy]-4-oxochromene-2-carboxylic acid
| 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) | 2.34 | 9.17 | -106.2 | 1 | 11 | -2 | 179 | 466.354 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Molecular_Solubility | 4.331 | Bitter DB |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0012925A1; EP0035749A1; EP0047226A2; EP0069385A2; EP0073506A1; EP0075140A1; EP0082546A1; EP0082546B2; EP0084190A2; EP0089666A2; EP0131477A1; EP0173186A1; EP0182349A1; EP0190449A1; EP0212927A1; EP0212927B1; EP0212959A2; EP0212959B1; EP0219207A2; EP021920 | IBM Patent Data |
