Compound Information | SONAR Target prediction | Name: | PERSEITOL | Unique Identifier: | SPE00202130 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 196.071 g/mol | X log p: | -3.419 (online calculus) | Lipinksi Failures | 0 | TPSA | 0 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 7 | Rotatable Bond Count: | 6 | Canonical Smiles: | OCC(O)C(O)C(O)C(O)C(O)CO | Class: | carbohydrate | Source: | Persia spp. | Reference: | J Am Chem Soc 61: 339 (1939); Carbohydr Res 150: 35 (1986) |
Species: |
4932 |
Condition: |
ARP1 |
Replicates: |
2 |
Raw OD Value: r im |
0.7478±0.00509117 |
Normalized OD Score: sc h |
1.0168±0.0172456 |
Z-Score: |
0.8140±0.805375 |
p-Value: |
0.486668 |
Z-Factor: |
-5.58893 |
Fitness Defect: |
0.7202 |
Bioactivity Statement: |
Nonactive |
Experimental Conditions | | Library: | Spectrum | Plate Number and Position: | 4|A11 | Drug Concentration: | 50.00 nM | OD Absorbance: | 600 nm | Robot Temperature: | 26.30 Celcius | Date: | 2006-03-23 YYYY-MM-DD | Plate CH Control (+): | 0.039425±0.00149 | Plate DMSO Control (-): | 0.727125±0.01467 | Plate Z-Factor: | 0.9534 |
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3511 |
n/a |
73051 |
n/a |
73499 |
n/a |
91498 |
(3S,5R,6R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,1 5,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol |
101748 |
heptane-1,2,3,4,5,6,7-heptol |
115361 |
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,4,6,7,8,9,11,12,14,15,16,17-t etradecahydrocyclopenta[a]phenanthrene-3,5,6-triol |
internal high similarity DBLink | Rows returned: 2 | |
nonactive | Cluster 2846 | Additional Members: 7 | Rows returned: 5 | |
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