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Compound InformationSONAR Target prediction
Name:

CITALOPRAM

Unique Identifier:SPE01504172
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C20FH21N2O
Molecular Weight:303.225 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:CN(C)CCCC1(OCc2cc(ccc21)C#N)c1ccc(F)cc1
Source:synthetic
Therapeutics:antidepressant, 5HT reuptake inhibitor

Found: 104 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [104]
Species: 4932
Condition: BCK1
Replicates: 2
Raw OD Value: r im 0.9180±0.0150614
Normalized OD Score: sc h 1.0109±0.0119917
Z-Score: -0.5783±0.623327
p-Value: 0.59942
Z-Factor: -10.2497
Fitness Defect: 0.5118
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:8|G2
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2010-08-10 YYYY-MM-DD
Plate CH Control (+):0.09499999999999999±0.00980
Plate DMSO Control (-):0.9554999999999999±0.02194
Plate Z-Factor:0.8527
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 2926 | Additional Members: 4 | Rows returned: 0
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