| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 29 | Yes |
Popular Name: N-[4-[5-(hydroxymethyl)-1,3-benzoxazol-2-yl]phenyl]-2-(2-methylphenoxy)acetamide N-[4-[5-(hydroxymethyl)-1,3-benz…
| 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) | 4.22 | 5.75 | -22.89 | 2 | 6 | 0 | 85 | 388.423 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CETP-1-E | Cholesteryl Ester Transfer Protein (cluster #1 Of 3), Eukaryotic | Eukaryotes | 1300 | 0.28 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| CETP_HUMAN | P11597 | Cholesteryl Ester Transfer Protein, Human | 1300 | 0.28 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| HDL-mediated lipid transport | |
| LDL-mediated lipid transport |
