| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2005 | 12 | Yes |
Popular Name: 3-Methyl-3-(1H-pyrrol-1-yl)butanoic acid 3-Methyl-3-(1H-pyrrol-1-yl)butan…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 395090-68-3 , [395090-68-3]
| 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) | 1.25 | 5.41 | -40.24 | 0 | 3 | -1 | 45 | 166.2 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 91 - 93° | Fluorochem |
| MP | 91-93° | Matrix Scientific |
| Purity | 95%+ | Fluorochem |
| Warnings | Irritant | Matrix Scientific |
