| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2005 | 11 | Yes |
Popular Name: 5-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-, ethyl ester (9CI) 5-Pyrimidinecarboxylic acid, 1,4…
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CAS Number: 188719-54-2
| 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) | 0.42 | -1.2 | -36.71 | 2 | 4 | 1 | 52 | 157.193 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACM1-4-E | Muscarinic Acetylcholine Receptor M1 (cluster #4 Of 5), Eukaryotic | Eukaryotes | 2200 | 0.72 | Binding ≤ 10μM |
| ACM2-5-E | Muscarinic Acetylcholine Receptor M2 (cluster #5 Of 6), Eukaryotic | Eukaryotes | 2200 | 0.72 | Binding ≤ 10μM |
| ACM3-4-E | Muscarinic Acetylcholine Receptor M3 (cluster #4 Of 5), Eukaryotic | Eukaryotes | 2200 | 0.72 | Binding ≤ 10μM |
| ACM4-6-E | Muscarinic Acetylcholine Receptor M4 (cluster #6 Of 6), Eukaryotic | Eukaryotes | 2200 | 0.72 | Binding ≤ 10μM |
| Z104303-2-O | Muscarinic Acetylcholine Receptor (cluster #2 Of 7), Other | Other | 2200 | 0.72 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104303 | Z104303 | Muscarinic Acetylcholine Receptor | 2200 | 0.72 | Binding ≤ 10μM |
| ACM1_RAT | P08482 | Muscarinic Acetylcholine Receptor M1, Rat | 2200 | 0.72 | Binding ≤ 10μM |
| ACM2_RAT | P10980 | Muscarinic Acetylcholine Receptor M2, Rat | 2200 | 0.72 | Binding ≤ 10μM |
| ACM3_RAT | P08483 | Muscarinic Acetylcholine Receptor M3, Rat | 2200 | 0.72 | Binding ≤ 10μM |
| ACM4_RAT | P08485 | Muscarinic Acetylcholine Receptor M4, Rat | 2200 | 0.72 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Acetylcholine regulates insulin secretion | |
| G alpha (i) signalling events | |
| G alpha (q) signalling events | |
| Muscarinic acetylcholine receptors |
