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Compound InformationSONAR Target prediction
Name:

isopropyl N-(3,5-dichlorophenyl)carbamate

Unique Identifier:SPB 07912
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H11NO2Cl2
Molecular Weight:237.018 g/mol
X log p:7.707  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:4
Canonical Smiles:CC(C)OC(=O)Nc1cc(Cl)cc(Cl)c1

Found: 65 nonactive | as graph: single | with analogs [1] << Back 21 22 23 24 25 26 27 28 29 30  Next >> [65]
Species: 4932
Condition: FAR1
Replicates: 2
Raw OD Value: r im 0.9275±0.013435
Normalized OD Score: sc h 0.9022±0.0105867
Z-Score: -0.6374±0.2786
p-Value: 0.531882
Z-Factor: 0.206294
Fitness Defect: 0.6313
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Bioactive
Plate Number and Position:9|H5
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2011-06-14 YYYY-MM-DD
Plate CH Control (+):0.10475000000000001±0.00452
Plate DMSO Control (-):1.03025±0.01611
Plate Z-Factor:0.9432
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DBLink | Rows returned: 2
2747130 propan-2-yl N-(3,5-dichlorophenyl)carbamate
4935479 tert-butyl N-(3,5-dichlorophenyl)carbamate

internal high similarity DBLink | Rows returned: 3
SPB 07911 0.9180
SPE00330051 0.9655
SEW 04919 0.9828

active | Cluster 17219 | Additional Members: 19 | Rows returned: 0

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