| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | No |
Popular Name: (1R,7S,9aS)-7-decyl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ol (1R,7S,9aS)-7-decyl-2,3,4,6,7,8,…
| 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) | 5.84 | 10.54 | -31.86 | 2 | 2 | 1 | 25 | 296.519 | 9 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7-2-E | Lanosterol Synthase (cluster #2 Of 3), Eukaryotic | Eukaryotes | 510 | 0.42 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7_HUMAN | P48449 | Lanosterol Synthase, Human | 430 | 0.42 | Binding ≤ 1μM |
| ERG7_HUMAN | P48449 | Lanosterol Synthase, Human | 430 | 0.42 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of gene expression by SREBF (SREBP) | |
| Cholesterol biosynthesis |
