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Compound InformationSONAR Target prediction
Name:

APIGENIN

Unique Identifier:SPE00200846
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H10O5
Molecular Weight:260.158 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:Oc1ccc(cc1)C1Oc2cc(O)cc(O)c2C(=O)C=1
Class:flavone
Source:parsley seed
Reference:J Chem Soc 1963: 1477; Eur J Cancer 32A: 146 (1996); J Biol Chem 271: 2262 (1996);
Carcinogenesis 10: 2325 (1994)
Therapeutics:antispasmodic, antineoplastic, topoisomerase I inhibitor

Found: 104 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [104]
Species: 4932
Condition: DCC1
Replicates: 2
Raw OD Value: r im 0.6616±0.00403051
Normalized OD Score: sc h 0.9981±0.00996997
Z-Score: -0.0980±0.460647
p-Value: 0.745812
Z-Factor: -29.006
Fitness Defect: 0.2933
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:24|H11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2008-06-25 YYYY-MM-DD
Plate CH Control (+):0.040725±0.00061
Plate DMSO Control (-):0.6529750000000001±0.01276
Plate Z-Factor:0.9272
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 1884 | Additional Members: 20 | Rows returned: 121 2 Next >> 
SPE01500717 0.452830188679245
SPE01500724 0.345454545454545
SPE01504115 0.294117647058823
SPE00200499 0.24
Prest49 0.24
Prest1131 0.191489361702128

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