| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 30th, 2009 | 28 | No |
Popular Name: LS-38404 LS-38404
| 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) | 8.30 | 9.94 | -9.74 | 3 | 5 | 0 | 87 | 394.552 | 17 | ↓ |
| Hi High (pH 8-9.5) | 8.30 | 10.85 | -42.03 | 2 | 5 | -1 | 90 | 393.544 | 17 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG1-3-E | Squalene Monooxygenase (cluster #3 Of 3), Eukaryotic | Eukaryotes | 590 | 0.31 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG1_RAT | P52020 | Squalene Monooxygenase, Rat | 590 | 0.31 | Binding ≤ 1μM |
| ERG1_RAT | P52020 | Squalene Monooxygenase, Rat | 590 | 0.31 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of gene expression by SREBF (SREBP) | |
| Cholesterol biosynthesis |
