In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 17 | No |
Popular Name: 4-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid methyl ester 4-(2,5-Dioxo-2,5-dihydro-pyrrol-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 40349-49-3
4-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid
benzoic acid, 4-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-, methyl ester
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) | 1.23 | 5.5 | -11.12 | 0 | 5 | 0 | 65 | 231.207 | 3 | ↓ |