| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 6th, 2010 | 13 | No |
Popular Name: (2S)-1,1-dimethyl-2-(5-methyl-2-furyl)pyrrolidin-1-ium (2S)-1,1-dimethyl-2-(5-methyl-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) | -2.17 | 8.34 | -28.46 | 0 | 2 | 1 | 13 | 180.271 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACM1-5-E | Muscarinic Acetylcholine Receptor M1 (cluster #5 Of 5), Eukaryotic | Eukaryotes | 5623 | 0.57 | Binding ≤ 10μM |
| ACM1-5-E | Muscarinic Acetylcholine Receptor M1 (cluster #5 Of 5), Eukaryotic | Eukaryotes | 7413 | 0.55 | Binding ≤ 10μM |
| ACM2-5-E | Muscarinic Acetylcholine Receptor M2 (cluster #5 Of 6), Eukaryotic | Eukaryotes | 1660 | 0.62 | Binding ≤ 10μM |
| ACM2-5-E | Muscarinic Acetylcholine Receptor M2 (cluster #5 Of 6), Eukaryotic | Eukaryotes | 1905 | 0.62 | Binding ≤ 10μM |
| ACM3-5-E | Muscarinic Acetylcholine Receptor M3 (cluster #5 Of 5), Eukaryotic | Eukaryotes | 2692 | 0.60 | Binding ≤ 10μM |
| ACM3-5-E | Muscarinic Acetylcholine Receptor M3 (cluster #5 Of 5), Eukaryotic | Eukaryotes | 6918 | 0.56 | Binding ≤ 10μM |
| ACM4-1-E | Muscarinic Acetylcholine Receptor M4 (cluster #1 Of 6), Eukaryotic | Eukaryotes | 4365 | 0.58 | Binding ≤ 10μM |
| ACM4-1-E | Muscarinic Acetylcholine Receptor M4 (cluster #1 Of 6), Eukaryotic | Eukaryotes | 5129 | 0.57 | Binding ≤ 10μM |
| ACM5-3-E | Muscarinic Acetylcholine Receptor M5 (cluster #3 Of 4), Eukaryotic | Eukaryotes | 3631 | 0.59 | Binding ≤ 10μM |
| ACM5-3-E | Muscarinic Acetylcholine Receptor M5 (cluster #3 Of 4), Eukaryotic | Eukaryotes | 4677 | 0.57 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACM1_HUMAN | P11229 | Muscarinic Acetylcholine Receptor M1, Human | 5623.41325 | 0.57 | Binding ≤ 10μM |
| ACM2_HUMAN | P08172 | Muscarinic Acetylcholine Receptor M2, Human | 1659.58691 | 0.62 | Binding ≤ 10μM |
| ACM3_HUMAN | P20309 | Muscarinic Acetylcholine Receptor M3, Human | 2691.5348 | 0.60 | Binding ≤ 10μM |
| ACM4_HUMAN | P08173 | Muscarinic Acetylcholine Receptor M4, Human | 5128.61384 | 0.57 | Binding ≤ 10μM |
| ACM5_HUMAN | P08912 | Muscarinic Acetylcholine Receptor M5, Human | 3630.78055 | 0.59 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Acetylcholine regulates insulin secretion | |
| G alpha (i) signalling events | |
| G alpha (q) signalling events | |
| Muscarinic acetylcholine receptors |
