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Compound InformationSONAR Target prediction
Name:

PHENOLPHTHALEIN

Unique Identifier:SPE01500480
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:304.212 g/mol
X log p:24.435  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:2
Canonical Smiles:Oc1ccc(cc1)C1(OC(=O)c2ccccc21)c1ccc(O)cc1
Source:synthetic
Therapeutics:cathartic

Found: 4 active | as graph: single | with analogs << Back 1 2 3 4
Species: 4932
Condition: CDC73
Replicates: 2
Raw OD Value: r im 0.3506±0.0106066
Normalized OD Score: sc h 0.8346±0.00186666
Z-Score: -4.1731±0.266003
p-Value: 0.0000402022
Z-Factor: -6.02094
Fitness Defect: 10.1216
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:16|H5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.80 Celcius
Date:2007-09-19 YYYY-MM-DD
Plate CH Control (+):0.04035±0.00052
Plate DMSO Control (-):0.414775±0.09621
Plate Z-Factor:0.1596
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DBLink | Rows returned: 4
4764 3,3-bis(4-hydroxyphenyl)isobenzofuran-1-one
68206 disodium 4-[1-(4-oxidophenyl)-3-oxo-isobenzofuran-1-yl]phenolate
228383 3-(4-hydroxyphenyl)-3-phenyl-isobenzofuran-1-one
343716 3-(4-hydroxyphenyl)-3H-isobenzofuran-1-one

internal high similarity DBLink | Rows returned: 0

active | Cluster 5860 | Additional Members: 5 | Rows returned: 0

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