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Compound InformationSONAR Target prediction
Name:

CHRYSIN

Unique Identifier:SPE01500709
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:244.158 g/mol
X log p:16.715  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Oc1cc(O)c2C(=O)C=C(Oc2c1)c1ccccc1
Class:flavone
Source:Pinus, Scutellaria, and Ulnus spp
Therapeutics:diuretic

Found: 548 nonactive | as graph: single | with analogs [1] << Back 521 522 523 524 525 526 527 528 529 530  Next >> [548]
Species: 4932
Condition: REF2
Replicates: 2
Raw OD Value: r im 0.3819±0.0138593
Normalized OD Score: sc h 0.9864±0.00103232
Z-Score: -0.4027±0.0283449
p-Value: 0.687216
Z-Factor: -4.27698
Fitness Defect: 0.3751
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:21|G11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.50 Celcius
Date:2008-08-27 YYYY-MM-DD
Plate CH Control (+):0.043125±0.00046
Plate DMSO Control (-):0.36512500000000003±0.01529
Plate Z-Factor:0.8501
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DBLink | Rows returned: 1
5281607 5,7-dihydroxy-2-phenyl-chromen-4-one

internal high similarity DBLink | Rows returned: 272 3 4 5 Next >> 
SPE01600652 0.9041
BTB 13702 0.9065
SPE01504068 0.9116
SPE00240958 0.9137
BTB 10082 0.9137
SPE01400010 0.9167

active | Cluster 1884 | Additional Members: 20 | Rows returned: 5
SPE01500724 0.345454545454545
SPE01504115 0.294117647058823
SPE00200499 0.24
SPE01505144 0.191489361702128
Prest122 0.1875

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