| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2009 | 20 | No |
Popular Name: (2E,5R,8E,13R)-5,13-dimethyl-6,14-dioxacyclotetradeca-2,8-diene-1,4,7,10-tetrone (2E,5R,8E,13R)-5,13-dimethyl-6,1…
| 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) | 0.54 | 6.61 | -13.86 | 0 | 6 | 0 | 87 | 280.276 | 0 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80362-4-O | P388 (Lymphoma Cells) (cluster #4 Of 8), Other | Other | 3900 | 0.38 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80362 | Z80362 | P388 (Lymphoma Cells) | 3900 | 0.38 | Functional ≤ 10μM |
