In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 12 | Yes |
Popular Name: Methyl quinuclidine-4-carboxylate Methyl quinuclidine-4-carboxylate
Find On: PubMed — Wikipedia — Google
CAS Number: 51069-26-2
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) | 0.81 | 5.4 | -41.91 | 1 | 3 | 1 | 31 | 170.232 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 2.97 | -4.51 | 0 | 3 | 0 | 30 | 169.224 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 165 - 166 | MolMall (formerly Molecular Diversity Preservation International) |
mp | 210 | MolMall (formerly Molecular Diversity Preservation International) |