| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 5th, 2010 | 21 | Yes |
Popular Name: N-(4,6-dimethyl-1-propyl-indolin-7-yl)-2,2-dimethyl-propanamide N-(4,6-dimethyl-1-propyl-indolin…
| 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) | 4.52 | 9.87 | -8.32 | 1 | 3 | 0 | 32 | 288.435 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q95214-1-E | Acyl-CoA:cholesterol Acyltransferase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 570 | 0.42 | Binding ≤ 10μM |
| Z80548-1-O | THP-1 (Acute Monocytic Leukemia Cells) (cluster #1 Of 5), Other | Other | 6900 | 0.34 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q95214_RABIT | Q95214 | Acyl-CoA:cholesterol Acyltransferase, Rabit | 570 | 0.42 | Binding ≤ 1μM |
| Q95214_RABIT | Q95214 | Acyl-CoA:cholesterol Acyltransferase, Rabit | 570 | 0.42 | Binding ≤ 10μM |
| Z80548 | Z80548 | THP-1 (Acute Monocytic Leukemia Cells) | 6900 | 0.34 | Functional ≤ 10μM |
