In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 4th, 2006 | 18 | No |
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) | 5.99 | 2.36 | -5.05 | 1 | 1 | 0 | 20 | 244.378 | 8 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Target | G2/mitotic-specific cyclin-B1(P14635)&Cyclin-A2(P20248) | Herbal Ingredients Targets |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50594-7-O | Mus Musculus (cluster #7 Of 9), Other | Other | 4800 | 0.41 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50594 | Z50594 | Mus Musculus | 4800 | 0.41 | Functional ≤ 10μM |