| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2008 | 26 | Yes |
Popular Name: Sesamin Sesamin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 133-04-0 , 607-80-7 , [133-04-0]
| 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) | 3.69 | 5.65 | -9.7 | 0 | 6 | 0 | 55 | 354.358 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Target | Heparin-binding growth factor 2(P09038)&Tumor necrosis factor(P01375) | Herbal Ingredients Targets |
| Target | NADPH oxidase 3(Q9HBY0)&NADPH oxidase 1(Q9Y5S8)&UDP-glucuronosyltransferase 1-1(P22309)&Cytochrome P450 2B6(P20813)&G1/S-specific cyclin-D1(P24385)&Nitric oxide synthase, endothelial(P29474)&Endothelin-converting enzyme 1(P42892)&Nitric oxide synthase, in | Herbal Ingredients Targets |
No pre-computed analogs available. Try a structural similarity search.