| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 24th, 2010 | 42 | No |
Popular Name: Proanthocyanidin A1 Proanthocyanidin A1
None
| 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) | 2.57 | -6.5 | -19.36 | 9 | 12 | 0 | 210 | 576.51 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.57 | -5.75 | -61.99 | 8 | 12 | -1 | 213 | 575.502 | 2 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z100081-1-O | PBMC (Peripheral Blood Mononuclear Cells) (cluster #1 Of 4), Other | Other | 5100 | 0.18 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z100081 | Z100081 | PBMC (Peripheral Blood Mononuclear Cells) | 5100 | 0.18 | Functional ≤ 10μM |
