| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 26th, 2009 | 27 | No |
| 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) | 7.27 | 12.09 | -8.14 | 1 | 3 | 0 | 41 | 379.629 | 11 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7-2-E | Lanosterol Synthase (cluster #2 Of 3), Eukaryotic | Eukaryotes | 700 | 0.32 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ERG7_RAT | P48450 | Lanosterol Synthase, Rat | 700 | 0.32 | Binding ≤ 1μM |
| ERG7_RAT | P48450 | Lanosterol Synthase, Rat | 700 | 0.32 | Binding ≤ 10μM |
