| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 16th, 2008 | 42 | No |
(3R,3'R)-Beta,Beta-Carotene-3,3'-Diol, Lutein
(3R,3'R,6S)-4,5-Didehydro-5,6-Dihydro-Beta,Beta-Carotene-3,3'-Diol
4,5-Didehydro-5,6-dihydro-beta,beta-carotene-3,3'-diol
| 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) | 9.31 | 18.98 | -6.17 | 2 | 2 | 0 | 40 | 568.886 | 10 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 7.32e-04 g/l | DrugBank-nutriceuticals |
| Target | Hepatocyte nuclear factor 1-alpha(P20823)&Zinc finger homeobox protein 3(Q15911)&25-hydroxycholesterol 7-alpha-hydroxylase(O75881)&3-hydroxy-3-methylglutaryl-coenzyme A reductase(P04035)&2'-5'-oligoadenylate synthase 3(Q9Y6K5)&Gastric intrinsic factor(P27 | Herbal Ingredients Targets |
