| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 5th, 2008 | 29 | No |
Popular Name: Agaricin Agaricin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 666-99-9 , [666-99-9]
| 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) | 6.12 | 15.55 | -208.59 | 1 | 7 | -3 | 141 | 413.531 | 20 | ↓ |
| Lo Low (pH 4.5-6) | 6.12 | 11.13 | -53.92 | 3 | 7 | -1 | 135 | 415.547 | 20 | ↓ |
| Lo Low (pH 4.5-6) | 6.12 | 13.57 | -108.9 | 2 | 7 | -2 | 138 | 414.539 | 20 | ↓ |
| Lo Low (pH 4.5-6) | 6.12 | 13.11 | -125.32 | 2 | 7 | -2 | 138 | 414.539 | 20 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| therap | antiperspirant | MicroSource Spectrum |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FDFT-1-E | Squalene Synthetase (cluster #1 Of 4), Eukaryotic | Eukaryotes | 9000 | 0.24 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| FDFT_RAT | Q02769 | Squalene Synthetase, Rat | 9000 | 0.24 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Activation of gene expression by SREBF (SREBP) | |
| Cholesterol biosynthesis | |
| PPARA activates gene expression |
