Compound Information | SONAR Target prediction | Name: | IRIGINOL HEXAACEATATE | Unique Identifier: | SPE00211012 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 548.281 g/mol | X log p: | 8.227 (online calculus) | Lipinksi Failures | 3 | TPSA | 184.1 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 14 | Rotatable Bond Count: | 13 | Canonical Smiles: | CC(=O)Oc1cc2OC=C(C(=O)c2c(OC(C)=O)c1OC(C)=O)c1cc(OC(C)=O)c(OC(C)=O)c(O C(C)=O)c1 | Class: | isoflavone | Source: | semisynthetic |
Species: |
4932 |
Condition: |
CIN8 |
Replicates: |
2 |
Raw OD Value: r im |
0.6819±0.00855599 |
Normalized OD Score: sc h |
0.9456±0.00631617 |
Z-Score: |
-2.5247±0.195749 |
p-Value: |
0.0123804 |
Z-Factor: |
-6.66485 |
Fitness Defect: |
4.3916 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 4|D10 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 25.30 Celcius | Date: | 2006-02-24 YYYY-MM-DD | Plate CH Control (+): | 0.03995±0.00452 | Plate DMSO Control (-): | 0.7626±0.02207 | Plate Z-Factor: | 0.9450 |
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DBLink | Rows returned: 1 | |
3505890 |
[5,7-diacetyloxy-4-oxo-3-(3,4,5-triacetyloxyphenyl)chromen-6-yl] acetate |
internal high similarity DBLink | Rows returned: 0 | |
active | Cluster 1426 | Additional Members: 2 | Rows returned: 0 | |
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