| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 23 | Yes |
Popular Name: 6-(2-Propenyl)-ergoline-8-carboxylic acid methyl ester 6-(2-Propenyl)-ergoline-8-carbox…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 72821-79-5 , [72821-79-5]
None
| 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) | 3.08 | 9.69 | -48.3 | 2 | 4 | 1 | 47 | 311.405 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.08 | 7.41 | -9.72 | 1 | 4 | 0 | 45 | 310.397 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
