| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 31st, 2008 | 22 | Yes |
Popular Name: 6-ethyl-N-(4-isopropylphenyl)-5-methyl-[1,2,4]triazolo[5,1-b]pyrimidin-7-amine 6-ethyl-N-(4-isopropylphenyl)-5-…
| 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) | 4.75 | 12.49 | -12.23 | 1 | 5 | 0 | 55 | 295.39 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q54A96-1-E | Dihydroorotate Dehydrogenase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1700 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q54A96_PLAFA | Q54A96 | Dihydroorotate Dehydrogenase, Plafa | 1700 | 0.37 | Binding ≤ 10μM |
