In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 24 | Yes |
Popular Name: AHR 324; Benzilic acid, 1-ethyl-3-pyrrolidinyl ester, hydrochloride; LS-32492 AHR 324; Benzilic acid, 1-ethyl-…
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) | 2.69 | 0.67 | -37.98 | 2 | 4 | 1 | 50 | 326.416 | 6 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z104303-1-O | Muscarinic Acetylcholine Receptor (cluster #1 Of 7), Other | Other | 1 | 0.53 | Binding ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z104303 | Z104303 | Muscarinic Acetylcholine Receptor | 0.66 | 0.54 | Binding ≤ 1μM |
Z104303 | Z104303 | Muscarinic Acetylcholine Receptor | 0.66 | 0.54 | Binding ≤ 10μM |