| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 22 | Yes |
Popular Name: 3-amino-N-benzyl-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide 3-amino-N-benzyl-4,6-dimethylthi…
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CAS Number: N/A
| 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) | 3.06 | -3.54 | -9.55 | 3 | 4 | 0 | 68 | 311.41 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | -3.5 | -32.88 | 4 | 4 | 1 | 69 | 312.418 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACM4-1-E | Muscarinic Acetylcholine Receptor M4 (cluster #1 Of 6), Eukaryotic | Eukaryotes | 1300 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACM4_RAT | P08485 | Muscarinic Acetylcholine Receptor M4, Rat | 1300 | 0.37 | Binding ≤ 10μM |
