| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2009 | 25 | Yes |
Popular Name: 3-(2-Methoxyphenyl)-5-methyl-6-phenylisoxazolo[4,5-c]pyridin-4(5H)-one 3-(2-Methoxyphenyl)-5-methyl-6-p…
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CAS Number: 479077-09-3
| 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) | 3.72 | 8.93 | -14.32 | 0 | 5 | 0 | 57 | 332.359 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM7-1-E | Metabotropic Glutamate Receptor 7 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 21 | 0.43 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| GRM7_RAT | P35400 | Metabotropic Glutamate Receptor 7, Rat | 21 | 0.43 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.