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Compound InformationSONAR Target prediction
Name:

NEOSTIGMINE BROMIDE

Unique Identifier:SPE01500428
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:284.045 g/mol
X log p:8.357  (online calculus)
Lipinksi Failures1
TPSA29.54
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:4
Canonical Smiles:[BrH-].CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Source:synthetic
Therapeutics:cholinergic

Found: 205 nonactive as graph: single | with analogs [1] << Back 61 62 63 64 65 66 67 68 69 70  Next >> [205]
Species: 4932
Condition: NTH1
Replicates: 2
Raw OD Value: r im 0.7132±0.00452548
Normalized OD Score: sc h 0.9980±0.00114284
Z-Score: -0.1095±0.0728533
p-Value: 0.912936
Z-Factor: -20.9127
Fitness Defect: 0.0911
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:5|F6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.10 Celcius
Date:2008-01-23 YYYY-MM-DD
Plate CH Control (+):0.0413±0.00022
Plate DMSO Control (-):0.687525±0.01558
Plate Z-Factor:0.9146
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DBLink | Rows returned: 10<< Back 1 2
46106 dimethyl-[3-(methylcarbamoyloxy)phenyl]azanium chloride
46107 (3-dimethylaminophenyl) N-methylcarbamate
47058 trimethyl-[3-(methylcarbamoyloxy)phenyl]azanium chloride
49115 [3-(dimethylcarbamoyloxy)phenyl]-dimethyl-azanium chloride

internal high similarity DBLink | Rows returned: 1
LOPAC 00212 1.0000

active | Cluster 2833 | Additional Members: 5 | Rows returned: 0
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