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Compound InformationSONAR Target prediction
Name:

FENDILINE HYDROCHLORIDE

Unique Identifier:SPE01501026
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:325.706 g/mol
X log p:31.653  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:7
Canonical Smiles:Cl.CC(NCCC(c1ccccc1)c1ccccc1)c1ccccc1
Source:synthetic
Therapeutics:coronary vasodilator

Found: 539 nonactive | as graph: single | with analogs [1] << Back 281 282 283 284 285 286 287 288 289 290  Next >> [539]
Species: 4932
Condition: SPE01504059
Replicates: 2
Raw OD Value: r im 0.7568±0.0544472
Normalized OD Score: sc h 0.9569±0.0144177
Z-Score: -1.0958±0.191054
p-Value: 0.277512
Z-Factor: -4.26659
Fitness Defect: 1.2819
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:2|C7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:21.90 Celcius
Date:2006-11-17 YYYY-MM-DD
Plate CH Control (+):0.040874999999999995±0.00242
Plate DMSO Control (-):0.821175±0.03203
Plate Z-Factor:0.7839
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DBLink | Rows returned: 5
3336 3,3-diphenyl-N-(1-phenylethyl)propan-1-amine
26154 3,3-diphenylpropyl-(1-phenylethyl)azanium chloride
657353 3,3-diphenyl-N-(1-phenylethyl)propan-1-amine; hydrogen(+1) cation; chloride
5702162 3,3-diphenyl-N-(1-phenylethyl)propan-1-amine hydrochloride
6604342 3,3-diphenyl-N-[(1S)-1-phenylethyl]propan-1-amine

internal high similarity DBLink | Rows returned: 0

active | Cluster 3400 | Additional Members: 5 | Rows returned: 0

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