| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2009 | 29 | No |
Popular Name: (5S)-5-[[4-hydroxy-4-(p-tolyl)-1-piperidyl]methyl]-3-(4-methoxyphenyl)oxazolidin-2-one (5S)-5-[[4-hydroxy-4-(p-tolyl)-1…
| 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) | 3.70 | 8.83 | -63.68 | 2 | 6 | 1 | 63 | 397.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.70 | 6.5 | -16.17 | 1 | 6 | 0 | 62 | 396.487 | 5 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| SGMR1-1-E | Sigma Opioid Receptor (cluster #1 Of 6), Eukaryotic | Eukaryotes | 19 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| SGMR1_HUMAN | Q99720 | Sigma Opioid Receptor, Human | 19 | 0.37 | Binding ≤ 1μM |
| SGMR1_HUMAN | Q99720 | Sigma Opioid Receptor, Human | 19 | 0.37 | Binding ≤ 10μM |
