| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 18 | Yes |
| 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) | 3.03 | 5.32 | -57.2 | 1 | 4 | -1 | 70 | 243.238 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PHHY-1-B | P-hydroxybenzoate Hydroxylase (cluster #1 Of 1), Bacterial | Bacteria | 69 | 0.56 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PHHY_PSEFL | P00438 | P-hydroxybenzoate Hydroxylase, Psefl | 59 | 0.56 | Binding ≤ 1μM |
| PHHY_PSEFL | P00438 | P-hydroxybenzoate Hydroxylase, Psefl | 59 | 0.56 | Binding ≤ 10μM |
