| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 30 | Yes |
| 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) | 4.76 | 2.05 | -9.95 | 1 | 5 | 0 | 72 | 418.574 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HMDH-1-E | HMG-CoA Reductase (cluster #1 Of 2), Eukaryotic | Eukaryotes | 12 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HMDH_HUMAN | P04035 | HMG-CoA Reductase, Human | 12.1 | 0.37 | Binding ≤ 1μM |
| HMDH_RAT | P51639 | HMG-CoA Reductase, Rat | 0.9 | 0.42 | Binding ≤ 1μM |
| HMDH_RAT | P51639 | HMG-CoA Reductase, Rat | 0.9 | 0.42 | Binding ≤ 10μM |
| HMDH_HUMAN | P04035 | HMG-CoA Reductase, Human | 12.1 | 0.37 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of gene expression by SREBF (SREBP) | |
| Cholesterol biosynthesis | |
| PPARA activates gene expression |
