In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 4th, 2010 | 23 | No |
Popular Name: N-3-oxo-tetradecanoyl-L-Homoserine lactone N-3-oxo-tetradecanoyl-L-Homoseri…
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CAS Number: 177158-19-9
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) | 3.17 | 11.08 | -26.04 | 1 | 5 | 0 | 72 | 325.449 | 13 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
LASR-1-B | Transcriptional Activator Protein LasR (cluster #1 Of 1), Bacterial | Bacteria | 15 | 0.48 | Functional ≤ 10μM |
Q9RMS5-1-B | PhzR (cluster #1 Of 1), Bacterial | Bacteria | 78 | 0.43 | Functional ≤ 10μM |
Z50594-4-O | Mus Musculus (cluster #4 Of 9), Other | Other | 6300 | 0.32 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z50594 | Z50594 | Mus Musculus | 6300 | 0.32 | Functional ≤ 10μM |
Q9RMS5_PSEAI | Q9RMS5 | PhzR, Pseai | 78 | 0.43 | Functional ≤ 10μM |
LASR_PSEAE | P25084 | Transcriptional Activator Protein LasR, Pseae | 10 | 0.49 | Functional ≤ 10μM |