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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 511 512 513 514 515 516 517 518 519 520  Next >> [539]
Species: 4932
Condition: SWI4
Replicates: 2
Raw OD Value: r im 0.5823±0.00247487
Normalized OD Score: sc h 1.0100±0.00906195
Z-Score: 0.4405±0.413187
p-Value: 0.67292
Z-Factor: -6.14779
Fitness Defect: 0.3961
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:22|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.30 Celcius
Date:2008-02-07 YYYY-MM-DD
Plate CH Control (+):0.043775±0.00082
Plate DMSO Control (-):0.5709±0.01520
Plate Z-Factor:0.8834
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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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