| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2009 | 29 | Yes |
Popular Name: ERGOCALCIFEROL ERGOCALCIFEROL
Find On: PubMed — Wikipedia — Google
CAS Number: 50-14-6
| 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) | 7.42 | 13.73 | -2.11 | 1 | 1 | 0 | 20 | 396.659 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Therapy | antirachitic vitamin | SMDC Pharmakon |
| therap | antirachitic vitamin; LD50 (rat) 56 mg/kg po | MicroSource Spectrum |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ANDR-2-E | Androgen Receptor (cluster #2 Of 4), Eukaryotic | Eukaryotes | 1 | 0.43 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ANDR_HUMAN | P10275 | Androgen Receptor, Human | 1.1 | 0.43 | Binding ≤ 1μM |
| ANDR_HUMAN | P10275 | Androgen Receptor, Human | 1.1 | 0.43 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Nuclear Receptor transcription pathway |
