| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 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) | 8.90 | 15.67 | -2.09 | 1 | 1 | 0 | 20 | 412.702 | 9 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7-3-E | Lanosterol Synthase (cluster #3 Of 3), Eukaryotic | Eukaryotes | 600 | 0.29 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7_RAT | P48450 | Lanosterol Synthase, Rat | 600 | 0.29 | Binding ≤ 1μM |
| ERG7_RAT | P48450 | Lanosterol Synthase, Rat | 600 | 0.29 | Binding ≤ 10μM |
