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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: 82 active | as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [82]
Species: 4932
Condition: SPE00305025
Replicates: 2
Raw OD Value: r im 0.1995±0
Normalized OD Score: sc h 0.6315±0
Z-Score: -8.0169±0
p-Value: 0.00000000000000108486
Z-Factor: 0.581343
Fitness Defect: 34.4573
Bioactivity Statement: Active
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:2|C7
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:0.00 Celcius
Date:2006-08-13 YYYY-MM-DD
Plate CH Control (+):0.03965±0.10458
Plate DMSO Control (-):0.3159±0.01653
Plate Z-Factor:-0.6069
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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

nonactive | Cluster 3400 | Additional Members: 5 | Rows returned: 3
LOPAC 00929 0.555555555555556
Prest878 0.404761904761905
Prest568 0

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