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Compound InformationSONAR Target prediction
Name:

POMIFERIN

Unique Identifier:SPE00201580
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:396.264 g/mol
X log p:15.175  (online calculus)
Lipinksi Failures1
TPSA35.53
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:3
Canonical Smiles:CC(C)=CCc1c(O)c2C(=O)C(=COc2c2C=CC(C)(C)Oc12)c1ccc(O)c(O)c1
Class:isoflavone
Source:Maclura pomifera
Reference:JACS 61:2832 (1939); 62:651 (1940); 63:1253 (1941); 68:406 (1946)
Therapeutics:antioxidant

Found: 123 nonactive | as graph: single | with analogs [1] << Back 81 82 83 84 85 86 87 88 89 90  Next >> [123]
Species: 4932
Condition: SAC3
Replicates: 2
Raw OD Value: r im 0.4229±0.0175362
Normalized OD Score: sc h 0.9587±0.0273045
Z-Score: -1.1169±0.872609
p-Value: 0.350054
Z-Factor: -4.69053
Fitness Defect: 1.0497
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:12|E7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.20 Celcius
Date:2008-05-16 YYYY-MM-DD
Plate CH Control (+):0.04035±0.00042
Plate DMSO Control (-):0.43062500000000004±0.02153
Plate Z-Factor:0.8281
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DBLink | Rows returned: 1
4871

internal high similarity DBLink | Rows returned: 1
SPE00201595 0.9526

active | Cluster 7497 | Additional Members: 7 | Rows returned: 4
SPE00201584 0.527472527472527
SPE00300348 0.476190476190476
SPE00201581 0.463414634146341
SPE00201595 0

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