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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 61 62 63 64 65
Species: 4932
Condition: YPI1
Replicates: 2
Raw OD Value: r im 0.9485±0.0219203
Normalized OD Score: sc h 0.9722±0.00878115
Z-Score: -0.3083±0.497987
p-Value: 0.737008
Z-Factor: -0.749265
Fitness Defect: 0.3052
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:2012-05-28 YYYY-MM-DD
Plate CH Control (+):0.09925±0.00795
Plate DMSO Control (-):0.995±0.00653
Plate Z-Factor:0.9576
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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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