| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 21 | No |
Popular Name: EPIESTRIOL EPIESTRIOL
| 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) | 2.51 | 2.69 | -6.73 | 3 | 3 | 0 | 61 | 288.387 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 99% | APIChem |
| Therapy | estrogen | SMDC Pharmakon |
| Target | RAC-alpha serine/threonine-protein kinase(P31749)&Glycogen synthase kinase-3 beta(P49841) | Herbal Ingredients Targets |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80224-1-O | MCF7 (Breast Carcinoma Cells) (cluster #1 Of 14), Other | Other | 0 | 0.00 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80224 | Z80224 | MCF7 (Breast Carcinoma Cells) | 0.1 | 0.67 | Functional ≤ 10μM |
