| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 11 | No |
Popular Name: 2,6-Dihydroxy-4-methylbenzaldehyde 2,6-Dihydroxy-4-methylbenzaldehyde
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CAS Number: 526-37-4
| 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) | 2.01 | -1.11 | -8.57 | 2 | 3 | 0 | 57 | 152.149 | 1 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50185-2-O | Staphylococcus Aureus (cluster #2 Of 4), Other | Other | 1640 | 0.74 | Functional ≤ 10μM |
| Z50186-1-O | Staphylococcus Epidermidis (cluster #1 Of 2), Other | Other | 1640 | 0.74 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50185 | Z50185 | Staphylococcus Aureus | 1640 | 0.74 | Functional ≤ 10μM |
| Z50186 | Z50186 | Staphylococcus Epidermidis | 1640 | 0.74 | Functional ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.