| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 20th, 2009 | 21 | Yes |
Popular Name: 1-[2-hydroxy-4-(6-hydroxyhexoxy)-3-propyl-phenyl]ethanone 1-[2-hydroxy-4-(6-hydroxyhexoxy)…
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) | 3.75 | 6.04 | -10.97 | 2 | 4 | 0 | 67 | 294.391 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.75 | 6.89 | -56.7 | 1 | 4 | -1 | 70 | 293.383 | 10 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50512-1-O | Cavia Porcellus (cluster #1 Of 7), Other | Other | 3981 | 0.36 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50512 | Z50512 | Cavia Porcellus | 3981.07171 | 0.36 | Functional ≤ 10μM |
