| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2010 | 31 | No |
Popular Name: 2,2-dimethyl-3-oxo-N-(2,4,6-trimethoxyphenyl)tetradecanamide 2,2-dimethyl-3-oxo-N-(2,4,6-trim…
None
| 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) | 6.95 | 12.57 | -20.35 | 1 | 6 | 0 | 74 | 435.605 | 16 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EST1-1-E | Acyl Coenzyme A:cholesterol Acyltransferase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 370 | 0.29 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| EST1_RABIT | P12337 | Acyl Coenzyme A:cholesterol Acyltransferase, Rabit | 370 | 0.29 | Functional ≤ 10μM |
