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Compound InformationSONAR Target prediction
Name:

CHLORPROPHAM

Unique Identifier:SPE00330051
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10ClH12NO2
Molecular Weight:201.565 g/mol
X log p:9.067  (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)Nc1cccc(Cl)c1
Therapeutics:herbicide, plant growth regulator

Found: 10 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 10 Next >> 
Species: 4932
Condition: MCK1
Replicates: 2
Raw OD Value: r im 0.5098±0.02885
Normalized OD Score: sc h 0.8627±0.0344241
Z-Score: -5.9007±1.92286
p-Value: 0.00000279906
Z-Factor: -4.46304
Fitness Defect: 12.7862
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:25|E3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.70 Celcius
Date:2007-11-13 YYYY-MM-DD
Plate CH Control (+):0.0402±0.00142
Plate DMSO Control (-):0.586175±0.08734
Plate Z-Factor:0.4825
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DBLink | Rows returned: 2
2728 propan-2-yl N-(3-chlorophenyl)carbamate
220166 tert-butyl N-(3-chlorophenyl)carbamate

internal high similarity DBLink | Rows returned: 3
SEW 04919 0.9483
SPB 07911 0.9492
SPB 07912 0.9655

active | Cluster 13997 | Additional Members: 51 | Rows returned: 2
BTB 06196 0.510638297872341
JP 00319 0.5

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